1h-indol-2-ylmethanamine (CED0219933)

Record Information
Version1.0
Creation Date2026-08-25 07:25:22 UTC
Update Date2026-08-25 07:25:22 UTC
SynCED IDCED0219933
Secondary Accession Numbers
  • CHEM261368
Identification
Common Name1h-indol-2-ylmethanamine
ClassSmall Molecule
Description
1h-indol-2-ylmethanamine belongs to the indoles, a subclass of indoles and derivatives within the organic compounds. This organoheterocyclic compound has the chemical formula C9H10N2 and an average molecular weight of 146.19 g/mol.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC9H10N2
Average Molecular Mass146.190 g/mol
Monoisotopic Mass146.084 g/mol
CAS Registry Number21109-25-1
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C9H10N2/c10-6-8-5-7-3-1-2-4-9(7)11-8/h1-5,11H,6,10H2
InChI KeyRNAODKZCUVVPEN-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
574.0 Log mg/kg [320:1000]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
CEDs000561Perfumes Within Detergents And Soaps?Perfumes within detergents and soaps are synthetic fragrance compounds added to enhance the sensory experience of cleaning products.Household cleaning & consumer productsPubChem
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Actin, cytoplasmic 1 structureClick to view 3D structureActin, cytoplasmic 1O93400Xenopus laevisPredicted (SEA)
Prediction Confidence Score
0.303
Applicability Domain
0.303
Statistical Significance
0.0016
Supporting Reference Compounds
1
E-value
12.6116
Fibroblast growth factor receptor 1 structureClick to view 3D structureFibroblast growth factor receptor 1P11362HumansPredicted (SEA)
Prediction Confidence Score
0.302
Applicability Domain
0.359
Statistical Significance
0.1062
Supporting Reference Compounds
1010
E-value
826.759
Platelet-derived growth factor receptor beta structureClick to view 3D structurePlatelet-derived growth factor receptor betaP09619HumansPredicted (SEA)
Prediction Confidence Score
0.297
Applicability Domain
0.359
Statistical Significance
0.0851
Supporting Reference Compounds
597
E-value
662.419
D-amino-acid oxidase structureClick to view 3D structureD-amino-acid oxidaseP14920HumansPredicted (SEA)
Prediction Confidence Score
0.296
Applicability Domain
0.424
Statistical Significance
9.50e-04
Supporting Reference Compounds
32
E-value
7.39568
D-amino-acid oxidase structureClick to view 3D structureD-amino-acid oxidaseP00371Sus scrofaPredicted (SEA)
Prediction Confidence Score
0.29
Applicability Domain
0.424
Statistical Significance
1.70e-04
Supporting Reference Compounds
15
E-value
1.32344
Platelet-derived growth factor receptor alpha structureClick to view 3D structurePlatelet-derived growth factor receptor alphaP16234HumansPredicted (SEA)
Prediction Confidence Score
0.287
Applicability Domain
0.359
Statistical Significance
0.0962
Supporting Reference Compounds
519
E-value
749.221
Cytochrome P450 2A6 structureClick to view 3D structureCytochrome P450 2A6P11509HumansPredicted (SEA)
Prediction Confidence Score
0.28
Applicability Domain
0.353
Statistical Significance
0.0028
Supporting Reference Compounds
68
E-value
21.4864
Aryl hydrocarbon receptor structureClick to view 3D structureAryl hydrocarbon receptorP35869HumansPredicted (SEA)
Prediction Confidence Score
0.276
Applicability Domain
0.429
Statistical Significance
0.0027
Supporting Reference Compounds
42
E-value
20.9414
D-aspartate oxidase structureClick to view 3D structureD-aspartate oxidaseQ99489HumansPredicted (SEA)
Prediction Confidence Score
0.271
Applicability Domain
0.424
Statistical Significance
1.50e-04
Supporting Reference Compounds
7
E-value
1.16774
Click to view 3D structureSecernin-3Q0VDG4HumansPredicted (SEA)
Prediction Confidence Score
0.265
Applicability Domain
0.265 Low confidence
Statistical Significance
9.40e-04
Supporting Reference Compounds
1
E-value
7.31783
Vascular endothelial growth factor receptor 2 structureClick to view 3D structureVascular endothelial growth factor receptor 2P35968HumansPredicted (SEA)
Prediction Confidence Score
0.264
Applicability Domain
0.288 Low confidence
Statistical Significance
0.3305
Supporting Reference Compounds
1660
E-value
2572.76
5-hydroxytryptamine receptor 2A structureClick to view 3D structure5-hydroxytryptamine receptor 2AP28223HumansPredicted (SEA)
Prediction Confidence Score
0.262
Applicability Domain
0.297 Low confidence
Statistical Significance
0.2092
Supporting Reference Compounds
955
E-value
1628.84
Pyruvate kinase structureClick to view 3D structurePyruvate kinaseQ6GG09Staphylococcus aureus (strain MRSA252)Predicted (SEA)
Prediction Confidence Score
0.259
Applicability Domain
0.259 Low confidence
Statistical Significance
0.0014
Supporting Reference Compounds
1
E-value
10.821
Receptor-type tyrosine-protein kinase FLT3 structureClick to view 3D structureReceptor-type tyrosine-protein kinase FLT3P36888HumansPredicted (SEA)
Prediction Confidence Score
0.259
Applicability Domain
0.359
Statistical Significance
0.3355
Supporting Reference Compounds
1274
E-value
2611.76
Click to view 3D structure5-hydroxytryptamine receptor 1AP19327Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.258
Applicability Domain
0.297 Low confidence
Statistical Significance
0.15
Supporting Reference Compounds
541
E-value
1167.58
5-hydroxytryptamine receptor 2B structureClick to view 3D structure5-hydroxytryptamine receptor 2BP41595HumansPredicted (SEA)
Prediction Confidence Score
0.257
Applicability Domain
0.268 Low confidence
Statistical Significance
0.1859
Supporting Reference Compounds
686
E-value
1447.14
D(3) dopamine receptor structureClick to view 3D structureD(3) dopamine receptorP35462HumansPredicted (SEA)
Prediction Confidence Score
0.257
Applicability Domain
0.288 Low confidence
Statistical Significance
0.2115
Supporting Reference Compounds
861
E-value
1646.74
D(2) dopamine receptor structureClick to view 3D structureD(2) dopamine receptorP14416HumansPredicted (SEA)
Prediction Confidence Score
0.257
Applicability Domain
0.288 Low confidence
Statistical Significance
0.2527
Supporting Reference Compounds
1103
E-value
1967.33
5-hydroxytryptamine receptor 2C structureClick to view 3D structure5-hydroxytryptamine receptor 2CP28335HumansPredicted (SEA)
Prediction Confidence Score
0.256
Applicability Domain
0.297 Low confidence
Statistical Significance
0.2252
Supporting Reference Compounds
823
E-value
1753.55
Click to view 3D structureSodium-dependent dopamine transporterP23977Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.255
Applicability Domain
0.297 Low confidence
Statistical Significance
0.0587
Supporting Reference Compounds
203
E-value
456.897
Proto-oncogene tyrosine-protein kinase Src structureClick to view 3D structureProto-oncogene tyrosine-protein kinase SrcP12931HumansPredicted (SEA)
Prediction Confidence Score
0.254
Applicability Domain
0.288 Low confidence
Statistical Significance
0.3428
Supporting Reference Compounds
1158
E-value
2669.06
Methionine aminopeptidase structureClick to view 3D structureMethionine aminopeptidaseP0AE18Escherichia coli (strain K12)Predicted (SEA)
Prediction Confidence Score
0.253
Applicability Domain
0.273 Low confidence
Statistical Significance
0.0024
Supporting Reference Compounds
13
E-value
18.9952
Trace amine-associated receptor 1 structureClick to view 3D structureTrace amine-associated receptor 1Q96RJ0HumansPredicted (SEA)
Prediction Confidence Score
0.253
Applicability Domain
0.297 Low confidence
Statistical Significance
0.021
Supporting Reference Compounds
63
E-value
163.328
5-hydroxytryptamine receptor 1A structureClick to view 3D structure5-hydroxytryptamine receptor 1AP08908HumansPredicted (SEA)
Prediction Confidence Score
0.253
Applicability Domain
0.288 Low confidence
Statistical Significance
0.2484
Supporting Reference Compounds
953
E-value
1933.62
D(4) dopamine receptor structureClick to view 3D structureD(4) dopamine receptorP21917HumansPredicted (SEA)
Prediction Confidence Score
0.251
Applicability Domain
0.288 Low confidence
Statistical Significance
0.1936
Supporting Reference Compounds
524
E-value
1507.47
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available