chempirical

1H-Indole-5-methanamine

C9H10N2CAS 81881-74-5146.19 g/mol

Open in Covalent MOL file
H2NNH
Primary amine

Properties

Molecular formula
C9H10N2
Molar mass
146.19 g/mol
Exact mass
146.0844 Da
logP
1.63Crippen estimate
Polar surface area
41.8 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
1

Identifiers

CAS number
81881-74-5
SMILES
NCc1ccc2[nH]ccc2c1
InChIKey
UAYYSAPJTRVEQA-UHFFFAOYSA-N
InChI
InChI=1S/C9H10N2/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-5,11H,6,10H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • 5-(Aminomethyl)indole
  • (1H-Indol-5-ylmethyl)amine
  • Indole-5-methanamine
  • ((Indol-5-yl)methyl)amine
  • 1-(1H-Indol-5-yl)methanamine
  • (1H-Indol-5-yl)methanamine

Work with 1H-Indole-5-methanamine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Indole-5-methanol1075-25-861 % similar 5-Aminoindole5192-03-052 % similar 5-Methylindole614-96-048 % similar 5-Bromoindole10075-50-047 % similar 5-Chloroindole17422-32-147 % similar 5-Hydroxyindole1953-54-447 % similar 5-Fluoroindole399-52-047 % similar 5-Benzyloxyindole1215-59-444 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1-Methyl-1H-indol-5-amine102308-97-4 3-(Phenylamino)propanenitrile1075-76-9 4-(Dimethylamino)benzonitrile1197-19-9 2-Ethylbenzimidazole1848-84-6 Dipyrrylmethane21211-65-4 Myosmine532-12-7 5,6-Dimethylbenzimidazole582-60-5 4-Amino-3,5-dimethylbenzonitrile74896-24-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook