1h-indol-5-ylmethanamine (CED0219932)

Record Information
Version1.0
Creation Date2026-08-25 07:25:05 UTC
Update Date2026-08-25 07:25:05 UTC
SynCED IDCED0219932
Secondary Accession Numbers
  • CHEM261365
Identification
Common Name1h-indol-5-ylmethanamine
ClassSmall Molecule
Description
1h-indol-5-ylmethanamine is an organic compound with the formula C9H10N2 and an average molecular weight of 146.19 g/mol. It has been identified in or released from one recorded source: Electrical & Electronic Equipment (Radio Transmission Systems). 1h-indol-5-ylmethanamine belongs to the indoles, a subclass of indoles and derivatives within the organic compounds.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC9H10N2
Average Molecular Mass146.190 g/mol
Monoisotopic Mass146.084 g/mol
CAS Registry Number81881-74-5
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C9H10N2/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-5,11H,6,10H2
InChI KeyUAYYSAPJTRVEQA-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
637.0 Log mg/kg [360:1100]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
CEDs000530Radio Transmission Systems?Radio transmission systems utilize a variety of synthetic chemicals in their manufacturing and maintenance processes.Electrical & Electronic EquipmentPubChem
CEDs000642Footwear?Footwear production often involves the use of various synthetic chemicals, such as adhesives, dyes, and treatments, which can contribute to environmental contamination.Textiles, leather & furnishingsPubChem
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
CEDs000741Pigment Pastes?Pigment pastes are concentrated dispersions of pigments used to impart color and properties to materials.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
Peroxidase structureClick to view 3D structurePeroxidaseK7N5L9Raphanus sativusPredicted (SEA)
Prediction Confidence Score
0.35
Applicability Domain
0.366
Statistical Significance
9.00e-05
Supporting Reference Compounds
2
E-value
0.700643
Carbonic anhydrase 6 structureClick to view 3D structureCarbonic anhydrase 6P23280HumansPredicted (SEA)
Prediction Confidence Score
0.302
Applicability Domain
0.414
Statistical Significance
0.0114
Supporting Reference Compounds
151
E-value
88.9817
Cytochrome P450 2A6 structureClick to view 3D structureCytochrome P450 2A6P11509HumansPredicted (SEA)
Prediction Confidence Score
0.282
Applicability Domain
0.5
Statistical Significance
0.0027
Supporting Reference Compounds
68
E-value
20.7079
Carbonic anhydrase 4 structureClick to view 3D structureCarbonic anhydrase 4P22748HumansPredicted (SEA)
Prediction Confidence Score
0.274
Applicability Domain
0.414
Statistical Significance
0.0261
Supporting Reference Compounds
193
E-value
203.576
Mitogen-activated protein kinase kinase kinase 11 structureClick to view 3D structureMitogen-activated protein kinase kinase kinase 11Q16584HumansPredicted (SEA)
Prediction Confidence Score
0.27
Applicability Domain
0.32
Statistical Significance
0.0501
Supporting Reference Compounds
153
E-value
390.258
Myeloperoxidase structureClick to view 3D structureMyeloperoxidaseP05164HumansPredicted (SEA)
Prediction Confidence Score
0.268
Applicability Domain
0.365
Statistical Significance
0.0078
Supporting Reference Compounds
43
E-value
60.6445
Carbonic anhydrase 9 structureClick to view 3D structureCarbonic anhydrase 9Q16790HumansPredicted (SEA)
Prediction Confidence Score
0.267
Applicability Domain
0.378
Statistical Significance
0.0811
Supporting Reference Compounds
372
E-value
631.513
Carbonic anhydrase 12 structureClick to view 3D structureCarbonic anhydrase 12O43570HumansPredicted (SEA)
Prediction Confidence Score
0.267
Applicability Domain
0.378
Statistical Significance
0.0717
Supporting Reference Compounds
332
E-value
558.568
Leucine-rich repeat serine/threonine-protein kinase 2 structureClick to view 3D structureLeucine-rich repeat serine/threonine-protein kinase 2Q5S007HumansPredicted (SEA)
Prediction Confidence Score
0.261
Applicability Domain
0.32
Statistical Significance
0.1494
Supporting Reference Compounds
336
E-value
1162.83
5-hydroxytryptamine receptor 2A structureClick to view 3D structure5-hydroxytryptamine receptor 2AP28223HumansPredicted (SEA)
Prediction Confidence Score
0.261
Applicability Domain
0.262 Low confidence
Statistical Significance
0.2192
Supporting Reference Compounds
955
E-value
1706.22
Click to view 3D structureSodium-dependent serotonin transporterP31652Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.261
Applicability Domain
0.262 Low confidence
Statistical Significance
0.0746
Supporting Reference Compounds
297
E-value
580.599
Voltage-gated inwardly rectifying potassium channel KCNH2 structureClick to view 3D structureVoltage-gated inwardly rectifying potassium channel KCNH2Q12809HumansPredicted (SEA)
Prediction Confidence Score
0.26
Applicability Domain
0.365
Statistical Significance
0.4389
Supporting Reference Compounds
1498
E-value
3417.19
Receptor-type tyrosine-protein kinase FLT3 structureClick to view 3D structureReceptor-type tyrosine-protein kinase FLT3P36888HumansPredicted (SEA)
Prediction Confidence Score
0.26
Applicability Domain
0.314
Statistical Significance
0.3272
Supporting Reference Compounds
1274
E-value
2547.46
Click to view 3D structureSodium-dependent dopamine transporterP23977Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.258
Applicability Domain
0.262 Low confidence
Statistical Significance
0.0535
Supporting Reference Compounds
203
E-value
416.883
Carbonic anhydrase 14 structureClick to view 3D structureCarbonic anhydrase 14Q9ULX7HumansPredicted (SEA)
Prediction Confidence Score
0.258
Applicability Domain
0.378
Statistical Significance
0.0493
Supporting Reference Compounds
172
E-value
384.186
Click to view 3D structureCarbonic anhydrase 15Q99N23Mus musculusPredicted (SEA)
Prediction Confidence Score
0.258
Applicability Domain
0.378
Statistical Significance
0.0202
Supporting Reference Compounds
78
E-value
157.411
Click to view 3D structureCarbonic anhydrase 13Q9D6N1Mus musculusPredicted (SEA)
Prediction Confidence Score
0.258
Applicability Domain
0.378
Statistical Significance
0.0174
Supporting Reference Compounds
70
E-value
135.769
Click to view 3D structureNorepinephrine transporterQ9WTR4Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.257
Applicability Domain
0.262 Low confidence
Statistical Significance
0.028
Supporting Reference Compounds
112
E-value
218.211
5-hydroxytryptamine receptor 2C structureClick to view 3D structure5-hydroxytryptamine receptor 2CP28335HumansPredicted (SEA)
Prediction Confidence Score
0.253
Applicability Domain
0.262 Low confidence
Statistical Significance
0.2501
Supporting Reference Compounds
823
E-value
1947.09
Tyrosine-protein kinase Lck structureClick to view 3D structureTyrosine-protein kinase LckP06239HumansPredicted (SEA)
Prediction Confidence Score
0.249
Applicability Domain
0.305
Statistical Significance
0.4116
Supporting Reference Compounds
1130
E-value
3204.35
Carbonic anhydrase 7 structureClick to view 3D structureCarbonic anhydrase 7P43166HumansPredicted (SEA)
Prediction Confidence Score
0.249
Applicability Domain
0.378
Statistical Significance
0.0881
Supporting Reference Compounds
242
E-value
686.085
5-hydroxytryptamine receptor 2B structureClick to view 3D structure5-hydroxytryptamine receptor 2BP41595HumansPredicted (SEA)
Prediction Confidence Score
0.247
Applicability Domain
0.262 Low confidence
Statistical Significance
0.257
Supporting Reference Compounds
686
E-value
2000.72
5-hydroxytryptamine receptor 1D structureClick to view 3D structure5-hydroxytryptamine receptor 1DP28221HumansPredicted (SEA)
Prediction Confidence Score
0.246
Applicability Domain
0.262 Low confidence
Statistical Significance
0.15
Supporting Reference Compounds
365
E-value
1167.5
Nuclear receptor subfamily 4 group A member 2 structureClick to view 3D structureNuclear receptor subfamily 4 group A member 2P43354HumansPredicted (SEA)
Prediction Confidence Score
0.246
Applicability Domain
0.5
Statistical Significance
0.0047
Supporting Reference Compounds
18
E-value
36.7448
Vascular endothelial growth factor receptor 2 structureClick to view 3D structureVascular endothelial growth factor receptor 2P35968HumansPredicted (SEA)
Prediction Confidence Score
0.246
Applicability Domain
0.289 Low confidence
Statistical Significance
0.4797
Supporting Reference Compounds
1660
E-value
3734.19
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available