2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol

C17H18N2O — CID 17027842

IUPAC2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol
SMILESCc1ccccc1Cn1c(CCO)nc2ccccc21
InChIInChI=1S/C17H18N2O/c1-13-6-2-3-7-14(13)12-19-16-9-5-4-8-15(16)18-17(19)10-11-20/h2-9,20H,10-12H2,1H3
InChIKeyWESCITPZXJKBBA-UHFFFAOYSA-N
MW266.34 g/mol
LogP2.93
Rot. Bonds4

About 2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol

2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol (PubChem CID 17027842) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol
PubChem CID17027842
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol
SMILESCc1ccccc1Cn1c(CCO)nc2ccccc21
InChIInChI=1S/C17H18N2O/c1-13-6-2-3-7-14(13)12-19-16-9-5-4-8-15(16)18-17(19)10-11-20/h2-9,20H,10-12H2,1H3
InChIKeyWESCITPZXJKBBA-UHFFFAOYSA-N
XLogP2.93
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;2-(1-ethylbenzimidazol-2-yl)ethanol
CID 142101886
[5-methyl-1-[(2-methylphenyl)methyl]benzimidazol-2-yl]methanol
CID 82333264
1-[(2-methylphenyl)methyl]-2-phenylbenzimidazole
CID 1320430
N-[3-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]propyl]prop-2-enamide
CID 16986719
2-fluoro-N-[3-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]propyl]benzamide
CID 16983003
2-(4-methoxyphenyl)-N-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethyl]acetamide
CID 16979574
N-[5-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]pentyl]-2-phenylacetamide
CID 16993340
N-[5-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]pentyl]prop-2-enamide
CID 16992206
4-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]aniline
CID 92629106
N-[2-[1-[(2-chlorophenyl)methyl]benzimidazol-2-yl]ethyl]-2-methylbenzamide
CID 16975895
3-methyl-N-[3-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]propyl]benzamide
CID 16983159
N-[5-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]pentyl]-3-phenylpropanamide
CID 16992530

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol?
The IUPAC name of 2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol (CID 17027842) is 2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol.
What is the SMILES notation for 2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol?
The canonical SMILES for 2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol is Cc1ccccc1Cn1c(CCO)nc2ccccc21.
What is the InChIKey of 2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol?
The InChIKey is WESCITPZXJKBBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-13-6-2-3-7-14(13)12-19-16-9-5-4-8-15(16)18-17(19)10-11-20/h2-9,20H,10-12H2,1H3.
What are the key properties of 2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol?
2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol has a molecular weight of 266.34 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol is sourced from PubChem (CID 17027842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).