3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride

C10H13ClN2O — CID 163211851

IUPAC3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride
SMILESCl.NCCc1c[nH]c2cc(O)ccc12
InChIInChI=1S/C10H12N2O.ClH/c11-4-3-7-6-12-10-5-8(13)1-2-9(7)10;/h1-2,5-6,12-13H,3-4,11H2;1H
InChIKeyIQVBOBFQEUCUHZ-UHFFFAOYSA-N
MW212.68 g/mol
LogP1.80
Rot. Bonds2

About 3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride

3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride (PubChem CID 163211851) has the molecular formula C10H13ClN2O and a molecular weight of 212.68 g/mol. Its IUPAC name is 3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride.

Molecular Properties

Compound Name3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride
PubChem CID163211851
Molecular FormulaC10H13ClN2O
Molecular Weight212.68 g/mol
Exact Mass212.07
IUPAC Name3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride
SMILESCl.NCCc1c[nH]c2cc(O)ccc12
InChIInChI=1S/C10H12N2O.ClH/c11-4-3-7-6-12-10-5-8(13)1-2-9(7)10;/h1-2,5-6,12-13H,3-4,11H2;1H
InChIKeyIQVBOBFQEUCUHZ-UHFFFAOYSA-N
XLogP1.80
TPSA62.04 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.68
LogP ≤ 51.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride?
The IUPAC name of 3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride (CID 163211851) is 3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride.
What is the SMILES notation for 3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride?
The canonical SMILES for 3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride is Cl.NCCc1c[nH]c2cc(O)ccc12.
What is the InChIKey of 3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride?
The InChIKey is IQVBOBFQEUCUHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O.ClH/c11-4-3-7-6-12-10-5-8(13)1-2-9(7)10;/h1-2,5-6,12-13H,3-4,11H2;1H.
What are the key properties of 3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride?
3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride has a molecular weight of 212.68 g/mol, XLogP of 1.80, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethyl)-1H-indol-6-ol;hydrochloride is sourced from PubChem (CID 163211851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).