1-hydroxy-2-phenylbenzimidazole

C13H10N2O — CID 606555

IUPAC1-hydroxy-2-phenylbenzimidazole
SMILESOn1c(-c2ccccc2)nc2ccccc21
InChIInChI=1S/C13H10N2O/c16-15-12-9-5-4-8-11(12)14-13(15)10-6-2-1-3-7-10/h1-9,16H
InChIKeyMVXMDWWPPYZUGR-UHFFFAOYSA-N
MW210.24 g/mol
LogP2.94
Rot. Bonds1

About 1-hydroxy-2-phenylbenzimidazole

1-hydroxy-2-phenylbenzimidazole (PubChem CID 606555) has the molecular formula C13H10N2O and a molecular weight of 210.24 g/mol. Its IUPAC name is 1-hydroxy-2-phenylbenzimidazole.

Molecular Properties

Compound Name1-hydroxy-2-phenylbenzimidazole
PubChem CID606555
Molecular FormulaC13H10N2O
Molecular Weight210.24 g/mol
Exact Mass210.08
IUPAC Name1-hydroxy-2-phenylbenzimidazole
SMILESOn1c(-c2ccccc2)nc2ccccc21
InChIInChI=1S/C13H10N2O/c16-15-12-9-5-4-8-11(12)14-13(15)10-6-2-1-3-7-10/h1-9,16H
InChIKeyMVXMDWWPPYZUGR-UHFFFAOYSA-N
XLogP2.94
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 ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Related Compounds

4-(1-hydroxybenzimidazol-2-yl)benzene-1,2-diol
CID 136600493
3-hydroxy-2-phenylbenzimidazole-5-carboxylic acid
CID 10083635
1-(3-hydroxy-2-phenylbenzimidazol-5-yl)ethanone
CID 10444910
2-phenyl-1-(trifluoromethyl)benzimidazole
CID 123856722
2-phenyl-1-(1-phenylethenyl)benzimidazole
CID 15370505
2-(2-phenylbenzimidazol-1-yl)acetic acid
CID 619876
1-(difluoromethyl)-2-phenylbenzimidazole
CID 91167618
(2-phenylbenzimidazol-1-yl) hypochlorite
CID 68724348
4-hydroxy-3,5-diphenyl-1,2,4-triazole
CID 14382453
1-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]benzimidazole
CID 18629889
9-phenyl-8,10-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2,4,6,9,11,13-heptaene
CID 122427077
1-(2-deuteriopropan-2-yl)-2-phenylbenzimidazole
CID 166563925

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-2-phenylbenzimidazole?
The IUPAC name of 1-hydroxy-2-phenylbenzimidazole (CID 606555) is 1-hydroxy-2-phenylbenzimidazole.
What is the SMILES notation for 1-hydroxy-2-phenylbenzimidazole?
The canonical SMILES for 1-hydroxy-2-phenylbenzimidazole is On1c(-c2ccccc2)nc2ccccc21.
What is the InChIKey of 1-hydroxy-2-phenylbenzimidazole?
The InChIKey is MVXMDWWPPYZUGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O/c16-15-12-9-5-4-8-11(12)14-13(15)10-6-2-1-3-7-10/h1-9,16H.
What are the key properties of 1-hydroxy-2-phenylbenzimidazole?
1-hydroxy-2-phenylbenzimidazole has a molecular weight of 210.24 g/mol, XLogP of 2.94, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-2-phenylbenzimidazole is sourced from PubChem (CID 606555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).