3-[2-(methylamino)ethyl]-1H-indol-4-ol

C11H14N2O — CID 14107683

IUPAC3-[2-(methylamino)ethyl]-1H-indol-4-ol
SMILESCNCCc1c[nH]c2cccc(O)c12
InChIInChI=1S/C11H14N2O/c1-12-6-5-8-7-13-9-3-2-4-10(14)11(8)9/h2-4,7,12-14H,5-6H2,1H3
InChIKeyMTJOWJUQGYWRHT-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.64
Rot. Bonds3

About 3-[2-(methylamino)ethyl]-1H-indol-4-ol

3-[2-(methylamino)ethyl]-1H-indol-4-ol (PubChem CID 14107683) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 3-[2-(methylamino)ethyl]-1H-indol-4-ol.

Molecular Properties

Compound Name3-[2-(methylamino)ethyl]-1H-indol-4-ol
PubChem CID14107683
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name3-[2-(methylamino)ethyl]-1H-indol-4-ol
SMILESCNCCc1c[nH]c2cccc(O)c12
InChIInChI=1S/C11H14N2O/c1-12-6-5-8-7-13-9-3-2-4-10(14)11(8)9/h2-4,7,12-14H,5-6H2,1H3
InChIKeyMTJOWJUQGYWRHT-UHFFFAOYSA-N
XLogP1.64
TPSA48.05 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 3-[2-(methylamino)ethyl]-1H-indol-4-ol 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-(methylamino)ethyl]-1H-indol-4-ol?
The IUPAC name of 3-[2-(methylamino)ethyl]-1H-indol-4-ol (CID 14107683) is 3-[2-(methylamino)ethyl]-1H-indol-4-ol.
What is the SMILES notation for 3-[2-(methylamino)ethyl]-1H-indol-4-ol?
The canonical SMILES for 3-[2-(methylamino)ethyl]-1H-indol-4-ol is CNCCc1c[nH]c2cccc(O)c12.
What is the InChIKey of 3-[2-(methylamino)ethyl]-1H-indol-4-ol?
The InChIKey is MTJOWJUQGYWRHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-12-6-5-8-7-13-9-3-2-4-10(14)11(8)9/h2-4,7,12-14H,5-6H2,1H3.
What are the key properties of 3-[2-(methylamino)ethyl]-1H-indol-4-ol?
3-[2-(methylamino)ethyl]-1H-indol-4-ol has a molecular weight of 190.25 g/mol, XLogP of 1.64, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(methylamino)ethyl]-1H-indol-4-ol is sourced from PubChem (CID 14107683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).