2-(aminomethyl)-1H-indol-7-ol

C9H10N2O — CID 82596264

IUPAC2-(aminomethyl)-1H-indol-7-ol
SMILESNCc1cc2cccc(O)c2[nH]1
InChIInChI=1S/C9H10N2O/c10-5-7-4-6-2-1-3-8(12)9(6)11-7/h1-4,11-12H,5,10H2
InChIKeyOEKHVTUEKRWJRJ-UHFFFAOYSA-N
MW162.19 g/mol
LogP1.33
Rot. Bonds1

About 2-(aminomethyl)-1H-indol-7-ol

2-(aminomethyl)-1H-indol-7-ol (PubChem CID 82596264) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is 2-(aminomethyl)-1H-indol-7-ol.

Molecular Properties

Compound Name2-(aminomethyl)-1H-indol-7-ol
PubChem CID82596264
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Name2-(aminomethyl)-1H-indol-7-ol
SMILESNCc1cc2cccc(O)c2[nH]1
InChIInChI=1S/C9H10N2O/c10-5-7-4-6-2-1-3-8(12)9(6)11-7/h1-4,11-12H,5,10H2
InChIKeyOEKHVTUEKRWJRJ-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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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-1H-indol-7-ol?
The IUPAC name of 2-(aminomethyl)-1H-indol-7-ol (CID 82596264) is 2-(aminomethyl)-1H-indol-7-ol.
What is the SMILES notation for 2-(aminomethyl)-1H-indol-7-ol?
The canonical SMILES for 2-(aminomethyl)-1H-indol-7-ol is NCc1cc2cccc(O)c2[nH]1.
What is the InChIKey of 2-(aminomethyl)-1H-indol-7-ol?
The InChIKey is OEKHVTUEKRWJRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O/c10-5-7-4-6-2-1-3-8(12)9(6)11-7/h1-4,11-12H,5,10H2.
What are the key properties of 2-(aminomethyl)-1H-indol-7-ol?
2-(aminomethyl)-1H-indol-7-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-7-ol is sourced from PubChem (CID 82596264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).