(1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol

C15H14N2O — CID 78941271

IUPAC(1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol
SMILESC[C@H](O)c1ccccc1-n1cnc2ccccc21
InChIInChI=1S/C15H14N2O/c1-11(18)12-6-2-4-8-14(12)17-10-16-13-7-3-5-9-15(13)17/h2-11,18H,1H3/t11-/m0/s1
InChIKeyZQKWBHMGMMKCCA-NSHDSACASA-N
MW238.29 g/mol
LogP3.08
Rot. Bonds2

About (1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol

(1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol (PubChem CID 78941271) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is (1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol.

Molecular Properties

Compound Name(1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol
PubChem CID78941271
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name(1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol
SMILESC[C@H](O)c1ccccc1-n1cnc2ccccc21
InChIInChI=1S/C15H14N2O/c1-11(18)12-6-2-4-8-14(12)17-10-16-13-7-3-5-9-15(13)17/h2-11,18H,1H3/t11-/m0/s1
InChIKeyZQKWBHMGMMKCCA-NSHDSACASA-N
XLogP3.08
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-ethylphenyl)benzimidazole
CID 22078308
1-(2,3-dichlorophenyl)benzimidazole
CID 42636654
3-(benzimidazol-1-yl)-2-methylbenzoic acid
CID 70364781
1-(2-bromo-4-propan-2-ylphenyl)benzimidazole
CID 174453392
1-(benzimidazol-1-yl)propane-1,2-diol
CID 22018573
[2-(benzimidazol-1-yl)phenyl]methanamine;hydrochloride
CID 75529767
3-(benzimidazol-1-yl)naphthalen-2-ol
CID 57307843
1-(benzimidazol-1-yl)propan-2-ol
CID 22504258
(1S)-1-[4-(benzimidazol-1-yl)phenyl]ethanamine
CID 25324450
4-(benzimidazol-1-yl)-2H-benzotriazole
CID 139651925
1-(5-chloro-2-pentan-3-ylphenyl)benzimidazole
CID 134401303
(1R)-1-[2-(5,6-dimethylbenzimidazol-1-yl)-5-fluorophenyl]ethanol
CID 63372224

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol?
The IUPAC name of (1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol (CID 78941271) is (1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol.
What is the SMILES notation for (1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol?
The canonical SMILES for (1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol is C[C@H](O)c1ccccc1-n1cnc2ccccc21.
What is the InChIKey of (1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol?
The InChIKey is ZQKWBHMGMMKCCA-NSHDSACASA-N. The full InChI is InChI=1S/C15H14N2O/c1-11(18)12-6-2-4-8-14(12)17-10-16-13-7-3-5-9-15(13)17/h2-11,18H,1H3/t11-/m0/s1.
What are the key properties of (1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol?
(1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol has a molecular weight of 238.29 g/mol, XLogP of 3.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[2-(benzimidazol-1-yl)phenyl]ethanol is sourced from PubChem (CID 78941271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).