2-(2-methylbenzimidazol-1-yl)-1-phenylethanol

C16H16N2O — CID 5200852

IUPAC2-(2-methylbenzimidazol-1-yl)-1-phenylethanol
SMILESCc1nc2ccccc2n1CC(O)c1ccccc1
InChIInChI=1S/C16H16N2O/c1-12-17-14-9-5-6-10-15(14)18(12)11-16(19)13-7-3-2-4-8-13/h2-10,16,19H,11H2,1H3
InChIKeyAXXDMHANFAYSEO-UHFFFAOYSA-N
MW252.32 g/mol
LogP3.08
Rot. Bonds3

About 2-(2-methylbenzimidazol-1-yl)-1-phenylethanol

2-(2-methylbenzimidazol-1-yl)-1-phenylethanol (PubChem CID 5200852) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-(2-methylbenzimidazol-1-yl)-1-phenylethanol.

Molecular Properties

Compound Name2-(2-methylbenzimidazol-1-yl)-1-phenylethanol
PubChem CID5200852
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC Name2-(2-methylbenzimidazol-1-yl)-1-phenylethanol
SMILESCc1nc2ccccc2n1CC(O)c1ccccc1
InChIInChI=1S/C16H16N2O/c1-12-17-14-9-5-6-10-15(14)18(12)11-16(19)13-7-3-2-4-8-13/h2-10,16,19H,11H2,1H3
InChIKeyAXXDMHANFAYSEO-UHFFFAOYSA-N
XLogP3.08
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2-methylbenzimidazol-1-yl)-1-phenylethanol 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 2-(2-methylbenzimidazol-1-yl)-1-phenylethanol?
The IUPAC name of 2-(2-methylbenzimidazol-1-yl)-1-phenylethanol (CID 5200852) is 2-(2-methylbenzimidazol-1-yl)-1-phenylethanol.
What is the SMILES notation for 2-(2-methylbenzimidazol-1-yl)-1-phenylethanol?
The canonical SMILES for 2-(2-methylbenzimidazol-1-yl)-1-phenylethanol is Cc1nc2ccccc2n1CC(O)c1ccccc1.
What is the InChIKey of 2-(2-methylbenzimidazol-1-yl)-1-phenylethanol?
The InChIKey is AXXDMHANFAYSEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O/c1-12-17-14-9-5-6-10-15(14)18(12)11-16(19)13-7-3-2-4-8-13/h2-10,16,19H,11H2,1H3.
What are the key properties of 2-(2-methylbenzimidazol-1-yl)-1-phenylethanol?
2-(2-methylbenzimidazol-1-yl)-1-phenylethanol has a molecular weight of 252.32 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylbenzimidazol-1-yl)-1-phenylethanol is sourced from PubChem (CID 5200852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).