2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole

C17H17ClN2O — CID 10447564

IUPAC2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole
SMILESCOC(C)c1ccc2c(c1)nc(-c1ccc(Cl)cc1)n2C
InChIInChI=1S/C17H17ClN2O/c1-11(21-3)13-6-9-16-15(10-13)19-17(20(16)2)12-4-7-14(18)8-5-12/h4-11H,1-3H3
InChIKeyCAMRKHNUPCFZTH-UHFFFAOYSA-N
MW300.79 g/mol
LogP4.60
Rot. Bonds3

About 2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole

2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole (PubChem CID 10447564) has the molecular formula C17H17ClN2O and a molecular weight of 300.79 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole.

Molecular Properties

Compound Name2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole
PubChem CID10447564
Molecular FormulaC17H17ClN2O
Molecular Weight300.79 g/mol
Exact Mass300.10
IUPAC Name2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole
SMILESCOC(C)c1ccc2c(c1)nc(-c1ccc(Cl)cc1)n2C
InChIInChI=1S/C17H17ClN2O/c1-11(21-3)13-6-9-16-15(10-13)19-17(20(16)2)12-4-7-14(18)8-5-12/h4-11H,1-3H3
InChIKeyCAMRKHNUPCFZTH-UHFFFAOYSA-N
XLogP4.60
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.79
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole 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

2-(4-chlorophenyl)-1-methylbenzimidazole
CID 974595
2-[2-(4-chlorophenyl)-1-methylbenzimidazol-5-yl]oxyethanol
CID 10494614
N-methyl-1-(1-methyl-2-phenylbenzimidazol-5-yl)ethanamine
CID 82501622
2-(3-chloro-4-fluorophenyl)-1-methylbenzimidazole-5-carbonitrile
CID 82879135
5-chloro-2-(3-fluorophenyl)-1-methylbenzimidazole
CID 47272714
5-chloro-1-methyl-2-pyridin-3-ylbenzimidazole
CID 10966745
6-chloro-1-methyl-2-phenylbenzimidazole
CID 12738431
1-(1,2-dimethylbenzimidazol-5-yl)-2-methylpropan-1-amine
CID 82493454
3-chloro-N-(4-chlorophenyl)-5-(5-fluoro-1-methylbenzimidazol-2-yl)pyridin-2-amine
CID 68721205
(1,2-dimethylbenzimidazol-5-yl)-(4-methoxyphenyl)methanamine
CID 91873506
4-(5-chloro-1-methylbenzimidazol-2-yl)-1,3-thiazole
CID 155566045
1-methyl-2-[4-(1-methyl-5-nitrobenzimidazol-2-yl)phenyl]-5-nitrobenzimidazole
CID 138618315

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole?
The IUPAC name of 2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole (CID 10447564) is 2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole.
What is the SMILES notation for 2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole?
The canonical SMILES for 2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole is COC(C)c1ccc2c(c1)nc(-c1ccc(Cl)cc1)n2C.
What is the InChIKey of 2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole?
The InChIKey is CAMRKHNUPCFZTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O/c1-11(21-3)13-6-9-16-15(10-13)19-17(20(16)2)12-4-7-14(18)8-5-12/h4-11H,1-3H3.
What are the key properties of 2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole?
2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole has a molecular weight of 300.79 g/mol, XLogP of 4.60, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-5-(1-methoxyethyl)-1-methylbenzimidazole is sourced from PubChem (CID 10447564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).