2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole

C15H13FN2 — CID 64722292

IUPAC2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole
SMILESCc1ccc(F)cc1-c1nc2c(C)cccc2[nH]1
InChIInChI=1S/C15H13FN2/c1-9-6-7-11(16)8-12(9)15-17-13-5-3-4-10(2)14(13)18-15/h3-8H,1-2H3,(H,17,18)
InChIKeyCEPKNGRYIZMYIT-UHFFFAOYSA-N
MW240.28 g/mol
LogP3.99
Rot. Bonds1

About 2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole

2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole (PubChem CID 64722292) has the molecular formula C15H13FN2 and a molecular weight of 240.28 g/mol. Its IUPAC name is 2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole.

Molecular Properties

Compound Name2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole
PubChem CID64722292
Molecular FormulaC15H13FN2
Molecular Weight240.28 g/mol
Exact Mass240.11
IUPAC Name2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole
SMILESCc1ccc(F)cc1-c1nc2c(C)cccc2[nH]1
InChIInChI=1S/C15H13FN2/c1-9-6-7-11(16)8-12(9)15-17-13-5-3-4-10(2)14(13)18-15/h3-8H,1-2H3,(H,17,18)
InChIKeyCEPKNGRYIZMYIT-UHFFFAOYSA-N
XLogP3.99
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.28
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(5-fluoro-2-methylphenyl)-4-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

Related Compounds

2-(5-fluoro-2-methylphenyl)-1H-benzimidazole-4-carbonitrile
CID 104720685
4-methyl-2-(2-methylphenyl)-1H-benzimidazole
CID 59018429
2-(5-fluoro-2-methylphenyl)-1H-imidazo[4,5-b]pyridine
CID 55144799
6-bromo-2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole
CID 104574515
2-(2,3-difluorophenyl)-4-methyl-1H-benzimidazole
CID 64724320
2-(2-bromo-3-methylphenyl)-4-methyl-1H-benzimidazole
CID 107983005
2-(4-fluoro-2-methylphenyl)-1H-benzimidazole-4-carbonitrile
CID 104720485
4-methyl-2-(2,4,6-trimethylphenyl)-1H-benzimidazole
CID 64723101
4-chloro-2-(2,5-dimethylphenyl)-1H-benzimidazole
CID 64723918
2-(3-chloro-4-methylphenyl)-4-methyl-1H-benzimidazole
CID 64722904
2-(2-ethoxyphenyl)-4-methyl-1H-benzimidazole
CID 60646509
2-(4-fluoro-1H-benzimidazol-2-yl)-6-methylaniline
CID 60783667

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole?
The IUPAC name of 2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole (CID 64722292) is 2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole.
What is the SMILES notation for 2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole?
The canonical SMILES for 2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole is Cc1ccc(F)cc1-c1nc2c(C)cccc2[nH]1.
What is the InChIKey of 2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole?
The InChIKey is CEPKNGRYIZMYIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2/c1-9-6-7-11(16)8-12(9)15-17-13-5-3-4-10(2)14(13)18-15/h3-8H,1-2H3,(H,17,18).
What are the key properties of 2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole?
2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole has a molecular weight of 240.28 g/mol, XLogP of 3.99, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-methylphenyl)-4-methyl-1H-benzimidazole is sourced from PubChem (CID 64722292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).