1-(2-chlorophenyl)-6-methylbenzimidazole

C14H11ClN2 — CID 58893460

IUPAC1-(2-chlorophenyl)-6-methylbenzimidazole
SMILESCc1ccc2ncn(-c3ccccc3Cl)c2c1
InChIInChI=1S/C14H11ClN2/c1-10-6-7-12-14(8-10)17(9-16-12)13-5-3-2-4-11(13)15/h2-9H,1H3
InChIKeyUHVCQSLLTZYWBN-UHFFFAOYSA-N
MW242.71 g/mol
LogP3.99
Rot. Bonds1

About 1-(2-chlorophenyl)-6-methylbenzimidazole

1-(2-chlorophenyl)-6-methylbenzimidazole (PubChem CID 58893460) has the molecular formula C14H11ClN2 and a molecular weight of 242.71 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-6-methylbenzimidazole.

Molecular Properties

Compound Name1-(2-chlorophenyl)-6-methylbenzimidazole
PubChem CID58893460
Molecular FormulaC14H11ClN2
Molecular Weight242.71 g/mol
Exact Mass242.06
IUPAC Name1-(2-chlorophenyl)-6-methylbenzimidazole
SMILESCc1ccc2ncn(-c3ccccc3Cl)c2c1
InChIInChI=1S/C14H11ClN2/c1-10-6-7-12-14(8-10)17(9-16-12)13-5-3-2-4-11(13)15/h2-9H,1H3
InChIKeyUHVCQSLLTZYWBN-UHFFFAOYSA-N
XLogP3.99
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.71
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-6-methylbenzimidazole?
The IUPAC name of 1-(2-chlorophenyl)-6-methylbenzimidazole (CID 58893460) is 1-(2-chlorophenyl)-6-methylbenzimidazole.
What is the SMILES notation for 1-(2-chlorophenyl)-6-methylbenzimidazole?
The canonical SMILES for 1-(2-chlorophenyl)-6-methylbenzimidazole is Cc1ccc2ncn(-c3ccccc3Cl)c2c1.
What is the InChIKey of 1-(2-chlorophenyl)-6-methylbenzimidazole?
The InChIKey is UHVCQSLLTZYWBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2/c1-10-6-7-12-14(8-10)17(9-16-12)13-5-3-2-4-11(13)15/h2-9H,1H3.
What are the key properties of 1-(2-chlorophenyl)-6-methylbenzimidazole?
1-(2-chlorophenyl)-6-methylbenzimidazole has a molecular weight of 242.71 g/mol, XLogP of 3.99, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-6-methylbenzimidazole is sourced from PubChem (CID 58893460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).