2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol

C14H12N2O — CID 84689140

IUPAC2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol
SMILESCn1cc(-c2ccccc2O)c2cccnc21
InChIInChI=1S/C14H12N2O/c1-16-9-12(10-5-2-3-7-13(10)17)11-6-4-8-15-14(11)16/h2-9,17H,1H3
InChIKeyVBDRFXCEKGIJJN-UHFFFAOYSA-N
MW224.26 g/mol
LogP2.95
Rot. Bonds1

About 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol

2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol (PubChem CID 84689140) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol.

Molecular Properties

Compound Name2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol
PubChem CID84689140
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol
SMILESCn1cc(-c2ccccc2O)c2cccnc21
InChIInChI=1S/C14H12N2O/c1-16-9-12(10-5-2-3-7-13(10)17)11-6-4-8-15-14(11)16/h2-9,17H,1H3
InChIKeyVBDRFXCEKGIJJN-UHFFFAOYSA-N
XLogP2.95
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol with MolForge

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

Launch Full Analysis

Related Compounds

2-(1-methylindol-3-yl)phenol
CID 154709769
1-methyl-3-[5-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-1H-pyrrol-2-yl]pyrrolo[2,3-b]pyridine
CID 155805321
3-fluoro-1-methylpyrrolo[2,3-b]pyridine
CID 153487723
N,N,1-trimethylpyrrolo[2,3-b]pyridin-3-amine
CID 174356978
1,4-dihydroxy-3-(2-hydroxyphenyl)-1,8-naphthyridin-2-one
CID 54735038
N-[(1-methylpyrrolo[2,3-b]pyridin-3-yl)methyl]hydroxylamine
CID 82653823
(1S)-2-amino-1-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethanol
CID 96855329
1-methyl-3-prop-1-ynylpyrrolo[2,3-b]pyridine
CID 59680675
2-amino-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethanol
CID 82656231
2-pyrimidin-2-ylphenol;zinc
CID 161346901
3-isocyanato-1-methylpyrrolo[2,3-b]pyridine
CID 83914634
8-hydroxy-6-methyl-1,6-naphthyridin-5-one
CID 59256580

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol?
The IUPAC name of 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol (CID 84689140) is 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol.
What is the SMILES notation for 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol?
The canonical SMILES for 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol is Cn1cc(-c2ccccc2O)c2cccnc21.
What is the InChIKey of 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol?
The InChIKey is VBDRFXCEKGIJJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c1-16-9-12(10-5-2-3-7-13(10)17)11-6-4-8-15-14(11)16/h2-9,17H,1H3.
What are the key properties of 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol?
2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol has a molecular weight of 224.26 g/mol, XLogP of 2.95, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)phenol is sourced from PubChem (CID 84689140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).