2-(aminomethyl)-1H-indol-5-ol

C9H10N2O — CID 14906013

IUPAC2-(aminomethyl)-1H-indol-5-ol
SMILESNCc1cc2cc(O)ccc2[nH]1
InChIInChI=1S/C9H10N2O/c10-5-7-3-6-4-8(12)1-2-9(6)11-7/h1-4,11-12H,5,10H2
InChIKeyXMQVTCLGKLXVDG-UHFFFAOYSA-N
MW162.19 g/mol
LogP1.33
Rot. Bonds1

About 2-(aminomethyl)-1H-indol-5-ol

2-(aminomethyl)-1H-indol-5-ol (PubChem CID 14906013) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is 2-(aminomethyl)-1H-indol-5-ol.

Molecular Properties

Compound Name2-(aminomethyl)-1H-indol-5-ol
PubChem CID14906013
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Name2-(aminomethyl)-1H-indol-5-ol
SMILESNCc1cc2cc(O)ccc2[nH]1
InChIInChI=1S/C9H10N2O/c10-5-7-3-6-4-8(12)1-2-9(6)11-7/h1-4,11-12H,5,10H2
InChIKeyXMQVTCLGKLXVDG-UHFFFAOYSA-N
XLogP1.33
TPSA62.04 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-(aminooxymethyl)-1H-indol-5-ol
CID 117195343
2-(5-hydroxy-1H-indol-2-yl)acetonitrile
CID 84766177
2-(5-hydroxy-1H-indol-2-yl)acetaldehyde
CID 22134437
2-(methylaminomethyl)-1H-indol-5-ol
CID 14906015
[5-(trifluoromethyl)-1H-indol-2-yl]methanamine
CID 117195095
1H-indole-2,5-diol
CID 45082883
3-(5-hydroxy-1H-indol-2-yl)-2,2-dimethylpropanoic acid
CID 117195358
ethyl 2-amino-3-(5-hydroxy-1H-indol-2-yl)propanoate;hydrochloride
CID 22402659
2-[[4-(trifluoromethyl)phenoxy]methyl]-1H-indol-5-ol
CID 117176788
5-hydroxy-1H-indole-2-carbohydrazide
CID 10877952
methyl 3-(5-hydroxy-1H-indol-2-yl)-2,2-dimethylpropanoate
CID 18947616
2-(aminomethyl)-1H-indol-7-ol
CID 82596264

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-1H-indol-5-ol?
The IUPAC name of 2-(aminomethyl)-1H-indol-5-ol (CID 14906013) is 2-(aminomethyl)-1H-indol-5-ol.
What is the SMILES notation for 2-(aminomethyl)-1H-indol-5-ol?
The canonical SMILES for 2-(aminomethyl)-1H-indol-5-ol is NCc1cc2cc(O)ccc2[nH]1.
What is the InChIKey of 2-(aminomethyl)-1H-indol-5-ol?
The InChIKey is XMQVTCLGKLXVDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O/c10-5-7-3-6-4-8(12)1-2-9(6)11-7/h1-4,11-12H,5,10H2.
What are the key properties of 2-(aminomethyl)-1H-indol-5-ol?
2-(aminomethyl)-1H-indol-5-ol has a molecular weight of 162.19 g/mol, XLogP of 1.33, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-1H-indol-5-ol is sourced from PubChem (CID 14906013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).