[1-(2-phenylethyl)benzimidazol-2-yl]methanol

C16H16N2O — CID 755510

IUPAC[1-(2-phenylethyl)benzimidazol-2-yl]methanol
SMILESOCc1nc2ccccc2n1CCc1ccccc1
InChIInChI=1S/C16H16N2O/c19-12-16-17-14-8-4-5-9-15(14)18(16)11-10-13-6-2-1-3-7-13/h1-9,19H,10-12H2
InChIKeyWCFBQXXGMITIAJ-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.77
Rot. Bonds4

About [1-(2-phenylethyl)benzimidazol-2-yl]methanol

[1-(2-phenylethyl)benzimidazol-2-yl]methanol (PubChem CID 755510) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is [1-(2-phenylethyl)benzimidazol-2-yl]methanol.

Molecular Properties

Compound Name[1-(2-phenylethyl)benzimidazol-2-yl]methanol
PubChem CID755510
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC Name[1-(2-phenylethyl)benzimidazol-2-yl]methanol
SMILESOCc1nc2ccccc2n1CCc1ccccc1
InChIInChI=1S/C16H16N2O/c19-12-16-17-14-8-4-5-9-15(14)18(16)11-10-13-6-2-1-3-7-13/h1-9,19H,10-12H2
InChIKeyWCFBQXXGMITIAJ-UHFFFAOYSA-N
XLogP2.77
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(2-phenylethyl)benzimidazol-2-yl]methanol 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 [1-(2-phenylethyl)benzimidazol-2-yl]methanol?
The IUPAC name of [1-(2-phenylethyl)benzimidazol-2-yl]methanol (CID 755510) is [1-(2-phenylethyl)benzimidazol-2-yl]methanol.
What is the SMILES notation for [1-(2-phenylethyl)benzimidazol-2-yl]methanol?
The canonical SMILES for [1-(2-phenylethyl)benzimidazol-2-yl]methanol is OCc1nc2ccccc2n1CCc1ccccc1.
What is the InChIKey of [1-(2-phenylethyl)benzimidazol-2-yl]methanol?
The InChIKey is WCFBQXXGMITIAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O/c19-12-16-17-14-8-4-5-9-15(14)18(16)11-10-13-6-2-1-3-7-13/h1-9,19H,10-12H2.
What are the key properties of [1-(2-phenylethyl)benzimidazol-2-yl]methanol?
[1-(2-phenylethyl)benzimidazol-2-yl]methanol has a molecular weight of 252.32 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-phenylethyl)benzimidazol-2-yl]methanol is sourced from PubChem (CID 755510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).