2-methylpyrazol-3-amine (CED0185948)

Record Information
Version1.0
Creation Date2026-08-22 18:29:29 UTC
Update Date2026-08-22 18:29:29 UTC
SynCED IDCED0185948
Secondary Accession Numbers
  • CHEM219367
Identification
Common Name2-methylpyrazol-3-amine
ClassSmall Molecule
Description
2-methylpyrazol-3-amine belongs to the pyrazoles, a subclass of azoles within the organic compounds. It is categorized as an organoheterocyclic compound with the formula C4H7N3. This substance has an average molecular weight of 97.12 g/mol.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC4H7N3
Average Molecular Mass97.120 g/mol
Monoisotopic Mass97.064 g/mol
CAS Registry Number1192-21-8
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C4H7N3/c1-7-4(5)2-3-6-7/h2-3H,5H2,1H3
InChI KeyJESRNIJXVIFVOV-UHFFFAOYSA-N
Chemical Taxonomy
ClassificationNot classified
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Organoleptic EffectsNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
SpectraNot Available
Toxicity Profile
Toxicity Values
Toxicity ValueOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalToxicity RatingReference
605.0 Log mg/kg [340:1100]RatLD50oralpredictedNot AvailableNot Available
Toxicity / Toxin ClassNot Available
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Health Effects
Health EffectRelationshipDirectionDescriptionReference
Exposure Sources
Source IDSourceSectorReference
CEDs000010Insecticides?Insecticides are synthetic chemicals designed to control or eliminate insect pests that threaten crops and other agricultural products.Agriculture & land managementPubChem
CEDs000600Herbicides And Algicides?Herbicides and algicides are synthetic chemicals primarily used to control unwanted plants and algae in various environments.Agriculture & land managementPubChem
CEDs000603Nematocides?Nematocides are synthetic chemicals specifically designed to control nematodes, which are microscopic roundworms that can cause significant damage to crops and plants.Agriculture & land managementPubChem
CEDs000606Plant Growth Regulators?Plant Growth Regulators (PGRs) are synthetic chemicals designed to influence the growth and development of plants.Agriculture & land managementPubChem
CEDs000631Anthraquinone Dyes?Anthraquinone dyes are a class of synthetic organic compounds characterized by their vibrant colors and stability, making them widely used in various applications, particularly in coloring textiles and leather.Textiles, leather & furnishingsPubChem
CEDs000633Azo Dyes?Azo dyes are synthetic organic compounds characterized by the presence of one or more azo groups (-N=N-), which are widely used for coloring textiles, leather, and furnishings.Textiles, leather & furnishingsPubChem
CEDs000648Nitro Dyes?Nitro dyes are synthetic colorants that contain nitro groups (-NO2) in their chemical structure.Textiles, leather & furnishingsPubChem
CEDs000685Ceramics?Ceramics can be a source of synthetic chemical contamination through various additives and processing agents used in their production.Building & ConstructionPubChem
CEDs000739Inks?Inks are complex mixtures composed of pigments or dyes, solvents, resins, and additives used primarily for printing and writing applications.Paper, pulp & fiber productsPubChem
CEDs000740Paper?Paper production involves the processing of wood fibers and the use of various chemicals, which can lead to synthetic chemical contamination.Paper, pulp & fiber productsPubChem
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Dual specificity protein kinase CLK4 structureClick to view 3D structureDual specificity protein kinase CLK4Q9HAZ1HumansPredicted (SEA)
Prediction Confidence Score
0.228
Applicability Domain
0.238 Low confidence
Statistical Significance
0.5209
Supporting Reference Compounds
742
E-value
4055.01
Cyclin-dependent kinase 5 structureClick to view 3D structureCyclin-dependent kinase 5Q00535HumansPredicted (SEA)
Prediction Confidence Score
0.225
Applicability Domain
0.238 Low confidence
Statistical Significance
0.5683
Supporting Reference Compounds
779
E-value
4424.33
Dual specificity tyrosine-phosphorylation-regulated kinase 1A structureClick to view 3D structureDual specificity tyrosine-phosphorylation-regulated kinase 1AQ13627HumansPredicted (SEA)
Prediction Confidence Score
0.222
Applicability Domain
0.231 Low confidence
Statistical Significance
0.632
Supporting Reference Compounds
906
E-value
4920.07
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform structureClick to view 3D structurePhosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoformO00329HumansPredicted (SEA)
Prediction Confidence Score
0.217
Applicability Domain
0.233 Low confidence
Statistical Significance
0.4442
Supporting Reference Compounds
459
E-value
3458.14
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform structureClick to view 3D structurePhosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoformP48736HumansPredicted (SEA)
Prediction Confidence Score
0.217
Applicability Domain
0.233 Low confidence
Statistical Significance
0.4475
Supporting Reference Compounds
450
E-value
3483.67
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform structureClick to view 3D structurePhosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoformP42336HumansPredicted (SEA)
Prediction Confidence Score
0.217
Applicability Domain
0.233 Low confidence
Statistical Significance
0.5064
Supporting Reference Compounds
536
E-value
3942.36
Dual specificity tyrosine-phosphorylation-regulated kinase 1B structureClick to view 3D structureDual specificity tyrosine-phosphorylation-regulated kinase 1BQ9Y463HumansPredicted (SEA)
Prediction Confidence Score
0.217
Applicability Domain
0.231 Low confidence
Statistical Significance
0.4927
Supporting Reference Compounds
377
E-value
3835.63
Serine/threonine-protein kinase Chk1 structureClick to view 3D structureSerine/threonine-protein kinase Chk1O14757HumansPredicted (SEA)
Prediction Confidence Score
0.217
Applicability Domain
0.231 Low confidence
Statistical Significance
0.6725
Supporting Reference Compounds
807
E-value
5235.44
LIM domain kinase 1 structureClick to view 3D structureLIM domain kinase 1P53667HumansPredicted (SEA)
Prediction Confidence Score
0.217
Applicability Domain
0.231 Low confidence
Statistical Significance
0.6055
Supporting Reference Compounds
565
E-value
4713.54
Glycogen synthase kinase-3 beta structureClick to view 3D structureGlycogen synthase kinase-3 betaP49841HumansPredicted (SEA)
Prediction Confidence Score
0.216
Applicability Domain
0.238 Low confidence
Statistical Significance
0.7536
Supporting Reference Compounds
1157
E-value
5866.8
Alpha-2C adrenergic receptor structureClick to view 3D structureAlpha-2C adrenergic receptorP18825HumansPredicted (SEA)
Prediction Confidence Score
0.215
Applicability Domain
0.25 Low confidence
Statistical Significance
0.3909
Supporting Reference Compounds
386
E-value
3043.52
Click to view 3D structureHistamine H4 receptorQ91ZY1Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.214
Applicability Domain
0.235 Low confidence
Statistical Significance
0.0182
Supporting Reference Compounds
22
E-value
141.841
Histamine H4 receptor structureClick to view 3D structureHistamine H4 receptorQ9H3N8HumansPredicted (SEA)
Prediction Confidence Score
0.212
Applicability Domain
0.22 Low confidence
Statistical Significance
0.2343
Supporting Reference Compounds
150
E-value
1823.7
DNA-dependent protein kinase catalytic subunit structureClick to view 3D structureDNA-dependent protein kinase catalytic subunitP78527HumansPredicted (SEA)
Prediction Confidence Score
0.21
Applicability Domain
0.224 Low confidence
Statistical Significance
0.2989
Supporting Reference Compounds
219
E-value
2327.3
Glycogen synthase kinase-3 alpha structureClick to view 3D structureGlycogen synthase kinase-3 alphaP49840HumansPredicted (SEA)
Prediction Confidence Score
0.21
Applicability Domain
0.238 Low confidence
Statistical Significance
0.7403
Supporting Reference Compounds
754
E-value
5763.18
Serine/threonine-protein kinase pim-1 structureClick to view 3D structureSerine/threonine-protein kinase pim-1P11309HumansPredicted (SEA)
Prediction Confidence Score
0.209
Applicability Domain
0.222 Low confidence
Statistical Significance
0.777
Supporting Reference Compounds
967
E-value
6048.57
Dual specificity tyrosine-phosphorylation-regulated kinase 2 structureClick to view 3D structureDual specificity tyrosine-phosphorylation-regulated kinase 2Q92630HumansPredicted (SEA)
Prediction Confidence Score
0.209
Applicability Domain
0.222 Low confidence
Statistical Significance
0.3885
Supporting Reference Compounds
196
E-value
3024.29
Ribosomal protein S6 kinase alpha-5 structureClick to view 3D structureRibosomal protein S6 kinase alpha-5O75582HumansPredicted (SEA)
Prediction Confidence Score
0.209
Applicability Domain
0.217 Low confidence
Statistical Significance
0.604
Supporting Reference Compounds
389
E-value
4702.09
Ephrin type-B receptor 4 structureClick to view 3D structureEphrin type-B receptor 4P54760HumansPredicted (SEA)
Prediction Confidence Score
0.208
Applicability Domain
0.224 Low confidence
Statistical Significance
0.4693
Supporting Reference Compounds
259
E-value
3653.23
Casein kinase I isoform alpha structureClick to view 3D structureCasein kinase I isoform alphaP48729HumansPredicted (SEA)
Prediction Confidence Score
0.207
Applicability Domain
0.225 Low confidence
Statistical Significance
0.737
Supporting Reference Compounds
674
E-value
5737.88
Dihydrofolate reductase structureClick to view 3D structureDihydrofolate reductaseP00378Gallus gallusPredicted (SEA)
Prediction Confidence Score
0.205
Applicability Domain
0.211 Low confidence
Statistical Significance
0.0262
Supporting Reference Compounds
33
E-value
203.965
Vascular endothelial growth factor receptor 2 structureClick to view 3D structureVascular endothelial growth factor receptor 2P35968HumansPredicted (SEA)
Prediction Confidence Score
0.205
Applicability Domain
0.217 Low confidence
Statistical Significance
0.8602
Supporting Reference Compounds
1660
E-value
6696.82
DNA-3-methyladenine glycosylase 1 structureClick to view 3D structureDNA-3-methyladenine glycosylase 1P05100Escherichia coli (strain K12)Predicted (SEA)
Prediction Confidence Score
0.205
Applicability Domain
0.205 Low confidence
Statistical Significance
0.0013
Supporting Reference Compounds
1
E-value
10.1204
Ribosomal protein S6 kinase beta-1 structureClick to view 3D structureRibosomal protein S6 kinase beta-1P23443HumansPredicted (SEA)
Prediction Confidence Score
0.205
Applicability Domain
0.217 Low confidence
Statistical Significance
0.7399
Supporting Reference Compounds
590
E-value
5759.99
Dual specificity protein kinase CLK2 structureClick to view 3D structureDual specificity protein kinase CLK2P49760HumansPredicted (SEA)
Prediction Confidence Score
0.205
Applicability Domain
0.217 Low confidence
Statistical Significance
0.7727
Supporting Reference Compounds
727
E-value
6015.49
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available