(4-methylpyridin-3-yl)methanamine (CED0200005)

Record Information
Version1.0
Creation Date2026-08-23 16:54:26 UTC
Update Date2026-08-23 16:54:26 UTC
SynCED IDCED0200005
Secondary Accession Numbers
  • CHEM236280
Identification
Common Name(4-methylpyridin-3-yl)methanamine
ClassSmall Molecule
Description
(4-methylpyridin-3-yl)methanamine belongs to the methylpyridines, a subclass of pyridines and derivatives within the organic compounds. It is an organoheterocyclic compound with the formula C7H10N2 and an average molecular weight of 122.17 g/mol.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC7H10N2
Average Molecular Mass122.170 g/mol
Monoisotopic Mass122.084 g/mol
CAS Registry Number1443-42-1
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C7H10N2/c1-6-2-3-9-5-7(6)4-8/h2-3,5H,4,8H2,1H3
InChI KeyVLIQJGACTLGWCQ-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
430.0 Log mg/kg [240:760]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
CEDs000530Radio Transmission Systems?Radio transmission systems utilize a variety of synthetic chemicals in their manufacturing and maintenance processes.Electrical & Electronic EquipmentPubChem
CEDs000659Transfer Printing?Transfer printing is a process used to apply designs and patterns onto various substrates, commonly utilizing synthetic dyes and inks that can contain hazardous chemicals.Textiles, leather & furnishingsPubChem
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Primary amine oxidase structureClick to view 3D structurePrimary amine oxidaseQ43077Pisum sativumPredicted (SEA)
Prediction Confidence Score
0.515
Applicability Domain
0.515
Statistical Significance
1.00e-05
Supporting Reference Compounds
1
E-value
0.0778492
Cytochrome P450 2A6 structureClick to view 3D structureCytochrome P450 2A6P11509HumansPredicted (SEA)
Prediction Confidence Score
0.413
Applicability Domain
0.471
Statistical Significance
1.20e-04
Supporting Reference Compounds
68
E-value
0.934191
Cytochrome P450 2D6 structureClick to view 3D structureCytochrome P450 2D6P10635HumansPredicted (SEA)
Prediction Confidence Score
0.394
Applicability Domain
0.471
Statistical Significance
0.0148
Supporting Reference Compounds
1130
E-value
115.528
Cytochrome P450 2B6 structureClick to view 3D structureCytochrome P450 2B6P20813HumansPredicted (SEA)
Prediction Confidence Score
0.391
Applicability Domain
0.459
Statistical Significance
7.10e-04
Supporting Reference Compounds
150
E-value
5.52729
Cytochrome P450 2C19 structureClick to view 3D structureCytochrome P450 2C19P33261HumansPredicted (SEA)
Prediction Confidence Score
0.382
Applicability Domain
0.471
Statistical Significance
0.0113
Supporting Reference Compounds
825
E-value
88.3589
Cytochrome P450 1A2 structureClick to view 3D structureCytochrome P450 1A2P05177HumansPredicted (SEA)
Prediction Confidence Score
0.38
Applicability Domain
0.459
Statistical Significance
0.0132
Supporting Reference Compounds
793
E-value
102.995
Cytochrome P450 2E1 structureClick to view 3D structureCytochrome P450 2E1P05181HumansPredicted (SEA)
Prediction Confidence Score
0.38
Applicability Domain
0.459
Statistical Significance
5.00e-05
Supporting Reference Compounds
31
E-value
0.389246
Cytochrome P450 2C8 structureClick to view 3D structureCytochrome P450 2C8P10632HumansPredicted (SEA)
Prediction Confidence Score
0.362
Applicability Domain
0.471
Statistical Significance
0.0054
Supporting Reference Compounds
305
E-value
41.805
Cytochrome P450 3A4 structureClick to view 3D structureCytochrome P450 3A4P08684HumansPredicted (SEA)
Prediction Confidence Score
0.347
Applicability Domain
0.471
Statistical Significance
0.0577
Supporting Reference Compounds
1538
E-value
448.879
Cytochrome P450 2C9 structureClick to view 3D structureCytochrome P450 2C9P11712HumansPredicted (SEA)
Prediction Confidence Score
0.296
Applicability Domain
0.316
Statistical Significance
0.1471
Supporting Reference Compounds
1245
E-value
1144.93
Click to view 3D structureCytochrome P450 2A5P20852Mus musculusPredicted (SEA)
Prediction Confidence Score
0.29
Applicability Domain
0.316
Statistical Significance
3.40e-04
Supporting Reference Compounds
11
E-value
2.64687
Amine oxidase [copper-containing] 3 structureClick to view 3D structureAmine oxidase [copper-containing] 3Q16853HumansPredicted (SEA)
Prediction Confidence Score
0.265
Applicability Domain
0.515
Statistical Significance
0.0015
Supporting Reference Compounds
22
E-value
11.6774
Click to view 3D structureCasein kinase I isoform deltaP81123Oryctolagus cuniculusPredicted (SEA)
Prediction Confidence Score
0.255
Applicability Domain
0.255 Low confidence
Statistical Significance
5.70e-04
Supporting Reference Compounds
1
E-value
4.43741
Rho-associated protein kinase 2 structureClick to view 3D structureRho-associated protein kinase 2O75116HumansPredicted (SEA)
Prediction Confidence Score
0.254
Applicability Domain
0.271 Low confidence
Statistical Significance
0.3017
Supporting Reference Compounds
811
E-value
2348.48
Rho-associated protein kinase 1 structureClick to view 3D structureRho-associated protein kinase 1Q13464HumansPredicted (SEA)
Prediction Confidence Score
0.254
Applicability Domain
0.271 Low confidence
Statistical Significance
0.3061
Supporting Reference Compounds
834
E-value
2383.35
Dual specificity tyrosine-phosphorylation-regulated kinase 1A structureClick to view 3D structureDual specificity tyrosine-phosphorylation-regulated kinase 1AQ13627HumansPredicted (SEA)
Prediction Confidence Score
0.253
Applicability Domain
0.271 Low confidence
Statistical Significance
0.3229
Supporting Reference Compounds
906
E-value
2514.14
Protein kinase C delta type structureClick to view 3D structureProtein kinase C delta typeQ05655HumansPredicted (SEA)
Prediction Confidence Score
0.252
Applicability Domain
0.261 Low confidence
Statistical Significance
0.2614
Supporting Reference Compounds
681
E-value
2035.29
Diamine oxidase [copper-containing] structureClick to view 3D structureDiamine oxidase [copper-containing]P19801HumansPredicted (SEA)
Prediction Confidence Score
0.251
Applicability Domain
0.515
Statistical Significance
3.90e-04
Supporting Reference Compounds
11
E-value
3.03612
Protein kinase C theta type structureClick to view 3D structureProtein kinase C theta typeQ04759HumansPredicted (SEA)
Prediction Confidence Score
0.251
Applicability Domain
0.261 Low confidence
Statistical Significance
0.1776
Supporting Reference Compounds
356
E-value
1382.52
Protein kinase C eta type structureClick to view 3D structureProtein kinase C eta typeP24723HumansPredicted (SEA)
Prediction Confidence Score
0.251
Applicability Domain
0.261 Low confidence
Statistical Significance
0.0625
Supporting Reference Compounds
145
E-value
486.791
Serine/threonine-protein kinase N2 structureClick to view 3D structureSerine/threonine-protein kinase N2Q16513HumansPredicted (SEA)
Prediction Confidence Score
0.249
Applicability Domain
0.261 Low confidence
Statistical Significance
0.2743
Supporting Reference Compounds
567
E-value
2135.48
Glycogen synthase kinase-3 beta structureClick to view 3D structureGlycogen synthase kinase-3 betaP49841HumansPredicted (SEA)
Prediction Confidence Score
0.248
Applicability Domain
0.25 Low confidence
Statistical Significance
0.4281
Supporting Reference Compounds
1157
E-value
3332.49
Ribosomal protein S6 kinase alpha-5 structureClick to view 3D structureRibosomal protein S6 kinase alpha-5O75582HumansPredicted (SEA)
Prediction Confidence Score
0.246
Applicability Domain
0.271 Low confidence
Statistical Significance
0.2295
Supporting Reference Compounds
389
E-value
1787.03
Lysine-specific demethylase 4C structureClick to view 3D structureLysine-specific demethylase 4CQ9H3R0HumansPredicted (SEA)
Prediction Confidence Score
0.246
Applicability Domain
0.286 Low confidence
Statistical Significance
0.029
Supporting Reference Compounds
72
E-value
225.451
Protein kinase C alpha type structureClick to view 3D structureProtein kinase C alpha typeP17252HumansPredicted (SEA)
Prediction Confidence Score
0.245
Applicability Domain
0.261 Low confidence
Statistical Significance
0.1118
Supporting Reference Compounds
258
E-value
870.432
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available