1H-benzimidazol-2-yl-(4-chlorophenyl)methanol

C14H11ClN2O — CID 21125

IUPAC1H-benzimidazol-2-yl-(4-chlorophenyl)methanol
SMILESOC(c1ccc(Cl)cc1)c1nc2ccccc2[nH]1
InChIInChI=1S/C14H11ClN2O/c15-10-7-5-9(6-8-10)13(18)14-16-11-3-1-2-4-12(11)17-14/h1-8,13,18H,(H,16,17)
InChIKeyMGOMPWPNDFWOMN-UHFFFAOYSA-N
MW258.71 g/mol
LogP3.30
Rot. Bonds2

About 1H-benzimidazol-2-yl-(4-chlorophenyl)methanol

1H-benzimidazol-2-yl-(4-chlorophenyl)methanol (PubChem CID 21125) has the molecular formula C14H11ClN2O and a molecular weight of 258.71 g/mol. Its IUPAC name is 1H-benzimidazol-2-yl-(4-chlorophenyl)methanol.

Molecular Properties

Compound Name1H-benzimidazol-2-yl-(4-chlorophenyl)methanol
PubChem CID21125
Molecular FormulaC14H11ClN2O
Molecular Weight258.71 g/mol
Exact Mass258.06
IUPAC Name1H-benzimidazol-2-yl-(4-chlorophenyl)methanol
SMILESOC(c1ccc(Cl)cc1)c1nc2ccccc2[nH]1
InChIInChI=1S/C14H11ClN2O/c15-10-7-5-9(6-8-10)13(18)14-16-11-3-1-2-4-12(11)17-14/h1-8,13,18H,(H,16,17)
InChIKeyMGOMPWPNDFWOMN-UHFFFAOYSA-N
XLogP3.30
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.71
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1H-benzimidazol-2-yl-(4-chlorophenyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

bis(1H-benzimidazol-2-yl)methanol
CID 3747179
(R)-(6-bromo-1H-benzimidazol-2-yl)-(4-chlorophenyl)methanol
CID 125481020
(4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol
CID 19804708
1H-benzimidazol-2-yl(cyclopenta-1,4-dien-1-yl)methanol
CID 91928092
1H-benzimidazol-2-yl-[4-(3-chloropyrazin-2-yl)oxyphenyl]methanol
CID 143998201
1,3-bis(1H-benzimidazol-2-yl)propane-1,2,3-triol
CID 2772761
(1S)-1-(1H-benzimidazol-2-yl)ethanol
CID 139074850
(2S,3S)-3-(1H-benzimidazol-2-yl)-1,1,1-trichloro-3-phenylpropan-2-ol
CID 1278594
N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-4-chlorobenzamide
CID 920428
3-(1H-benzimidazol-2-yl)-2,3-dihydroxypropanoic acid
CID 2828965
(2R,3S)-3-(1H-benzimidazol-2-yl)-2,3-dihydroxypropanoic acid
CID 785137
2-(1H-benzimidazol-2-yl)-3-(4-chlorophenyl)propan-1-amine
CID 83976079

Frequently Asked Questions

What is the IUPAC name of 1H-benzimidazol-2-yl-(4-chlorophenyl)methanol?
The IUPAC name of 1H-benzimidazol-2-yl-(4-chlorophenyl)methanol (CID 21125) is 1H-benzimidazol-2-yl-(4-chlorophenyl)methanol.
What is the SMILES notation for 1H-benzimidazol-2-yl-(4-chlorophenyl)methanol?
The canonical SMILES for 1H-benzimidazol-2-yl-(4-chlorophenyl)methanol is OC(c1ccc(Cl)cc1)c1nc2ccccc2[nH]1.
What is the InChIKey of 1H-benzimidazol-2-yl-(4-chlorophenyl)methanol?
The InChIKey is MGOMPWPNDFWOMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2O/c15-10-7-5-9(6-8-10)13(18)14-16-11-3-1-2-4-12(11)17-14/h1-8,13,18H,(H,16,17).
What are the key properties of 1H-benzimidazol-2-yl-(4-chlorophenyl)methanol?
1H-benzimidazol-2-yl-(4-chlorophenyl)methanol has a molecular weight of 258.71 g/mol, XLogP of 3.30, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-benzimidazol-2-yl-(4-chlorophenyl)methanol is sourced from PubChem (CID 21125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).