6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole

C14H10ClFN2 — CID 60648959

IUPAC6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole
SMILESFc1ccccc1Cc1nc2ccc(Cl)cc2[nH]1
InChIInChI=1S/C14H10ClFN2/c15-10-5-6-12-13(8-10)18-14(17-12)7-9-3-1-2-4-11(9)16/h1-6,8H,7H2,(H,17,18)
InChIKeyCEVGBDAGURYZHD-UHFFFAOYSA-N
MW260.70 g/mol
LogP3.95
Rot. Bonds2

About 6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole

6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole (PubChem CID 60648959) has the molecular formula C14H10ClFN2 and a molecular weight of 260.70 g/mol. Its IUPAC name is 6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole.

Molecular Properties

Compound Name6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole
PubChem CID60648959
Molecular FormulaC14H10ClFN2
Molecular Weight260.70 g/mol
Exact Mass260.05
IUPAC Name6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole
SMILESFc1ccccc1Cc1nc2ccc(Cl)cc2[nH]1
InChIInChI=1S/C14H10ClFN2/c15-10-5-6-12-13(8-10)18-14(17-12)7-9-3-1-2-4-11(9)16/h1-6,8H,7H2,(H,17,18)
InChIKeyCEVGBDAGURYZHD-UHFFFAOYSA-N
XLogP3.95
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.70
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole?
The IUPAC name of 6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole (CID 60648959) is 6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole.
What is the SMILES notation for 6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole?
The canonical SMILES for 6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole is Fc1ccccc1Cc1nc2ccc(Cl)cc2[nH]1.
What is the InChIKey of 6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole?
The InChIKey is CEVGBDAGURYZHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClFN2/c15-10-5-6-12-13(8-10)18-14(17-12)7-9-3-1-2-4-11(9)16/h1-6,8H,7H2,(H,17,18).
What are the key properties of 6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole?
6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole has a molecular weight of 260.70 g/mol, XLogP of 3.95, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-[(2-fluorophenyl)methyl]-1H-benzimidazole is sourced from PubChem (CID 60648959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).