4-(benzimidazol-1-yl)phenol

C13H10N2O — CID 5328449

IUPAC4-(benzimidazol-1-yl)phenol
SMILESOc1ccc(-n2cnc3ccccc32)cc1
InChIInChI=1S/C13H10N2O/c16-11-7-5-10(6-8-11)15-9-14-12-3-1-2-4-13(12)15/h1-9,16H
InChIKeyYPKCOJPZSAGCHD-UHFFFAOYSA-N
MW210.24 g/mol
LogP2.73
Rot. Bonds1

About 4-(benzimidazol-1-yl)phenol

4-(benzimidazol-1-yl)phenol (PubChem CID 5328449) has the molecular formula C13H10N2O and a molecular weight of 210.24 g/mol. Its IUPAC name is 4-(benzimidazol-1-yl)phenol.

Molecular Properties

Compound Name4-(benzimidazol-1-yl)phenol
PubChem CID5328449
Molecular FormulaC13H10N2O
Molecular Weight210.24 g/mol
Exact Mass210.08
IUPAC Name4-(benzimidazol-1-yl)phenol
SMILESOc1ccc(-n2cnc3ccccc32)cc1
InChIInChI=1S/C13H10N2O/c16-11-7-5-10(6-8-11)15-9-14-12-3-1-2-4-13(12)15/h1-9,16H
InChIKeyYPKCOJPZSAGCHD-UHFFFAOYSA-N
XLogP2.73
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(benzimidazol-1-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

1-(p-Hydroxyphenyl)imidazole
CID 82315
6-Methoxy-1-phenyl-1H-benzimidazole
CID 652633
1-Phenyl-5-hydroxybenzimidazole
CID 667662
1H-Benzimidazole, 5-methoxy-1-phenyl-
CID 5328466
5-ethoxy-1-phenyl-1H-1,3-benzodiazole
CID 5328497
1-phenyl-5-(prop-2-en-1-yloxy)-1H-1,3-benzodiazole
CID 5328501
4-[(1-phenyl-1H-1,3-benzodiazol-5-yl)oxy]butan-1-ol
CID 5328502
4-(5-methoxy-1H-1,3-benzodiazol-1-yl)aniline
CID 5328512
1-phenyl-1H-1,3-benzodiazole-4,5-diol
CID 5328517
4-(2-phenyl-1H-benzo[d]imidazol-1-yl)phenol
CID 44405888
2-[1-(2-hydroxybenzyl)-1H-benzimidazol-2-yl]phenol
CID 682797
2-[[(1-Prop-2-enylbenzimidazol-2-yl)amino]methyl]phenol
CID 890291

Frequently Asked Questions

What is the IUPAC name of 4-(benzimidazol-1-yl)phenol?
The IUPAC name of 4-(benzimidazol-1-yl)phenol (CID 5328449) is 4-(benzimidazol-1-yl)phenol.
What is the SMILES notation for 4-(benzimidazol-1-yl)phenol?
The canonical SMILES for 4-(benzimidazol-1-yl)phenol is Oc1ccc(-n2cnc3ccccc32)cc1.
What is the InChIKey of 4-(benzimidazol-1-yl)phenol?
The InChIKey is YPKCOJPZSAGCHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O/c16-11-7-5-10(6-8-11)15-9-14-12-3-1-2-4-13(12)15/h1-9,16H.
What are the key properties of 4-(benzimidazol-1-yl)phenol?
4-(benzimidazol-1-yl)phenol has a molecular weight of 210.24 g/mol, XLogP of 2.73, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(benzimidazol-1-yl)phenol is sourced from PubChem (CID 5328449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).