4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol

C11H11NO2 — CID 174468832

IUPAC4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol
SMILESOCc1ccc(O)c(-c2ccc[nH]2)c1
InChIInChI=1S/C11H11NO2/c13-7-8-3-4-11(14)9(6-8)10-2-1-5-12-10/h1-6,12-14H,7H2
InChIKeyRWAJWELXRSNGGJ-UHFFFAOYSA-N
MW189.21 g/mol
LogP1.88
Rot. Bonds2

About 4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol

4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol (PubChem CID 174468832) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is 4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol.

Molecular Properties

Compound Name4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol
PubChem CID174468832
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol
SMILESOCc1ccc(O)c(-c2ccc[nH]2)c1
InChIInChI=1S/C11H11NO2/c13-7-8-3-4-11(14)9(6-8)10-2-1-5-12-10/h1-6,12-14H,7H2
InChIKeyRWAJWELXRSNGGJ-UHFFFAOYSA-N
XLogP1.88
TPSA56.25 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 51.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 4-(hydroxymethyl)-2-(1H-pyrrol-2-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

Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol?
The IUPAC name of 4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol (CID 174468832) is 4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol.
What is the SMILES notation for 4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol?
The canonical SMILES for 4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol is OCc1ccc(O)c(-c2ccc[nH]2)c1.
What is the InChIKey of 4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol?
The InChIKey is RWAJWELXRSNGGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c13-7-8-3-4-11(14)9(6-8)10-2-1-5-12-10/h1-6,12-14H,7H2.
What are the key properties of 4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol?
4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol has a molecular weight of 189.21 g/mol, XLogP of 1.88, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol is sourced from PubChem (CID 174468832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).