1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole

C20H15FN2 — CID 95930125

IUPAC1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole
SMILESCc1ccc(-c2nc3ccccc3n2-c2ccc(F)cc2)cc1
InChIInChI=1S/C20H15FN2/c1-14-6-8-15(9-7-14)20-22-18-4-2-3-5-19(18)23(20)17-12-10-16(21)11-13-17/h2-13H,1H3
InChIKeyJHZIRCUQSOTJSZ-UHFFFAOYSA-N
MW302.35 g/mol
LogP5.14
Rot. Bonds2

About 1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole

1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole (PubChem CID 95930125) has the molecular formula C20H15FN2 and a molecular weight of 302.35 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole
PubChem CID95930125
Molecular FormulaC20H15FN2
Molecular Weight302.35 g/mol
Exact Mass302.12
IUPAC Name1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole
SMILESCc1ccc(-c2nc3ccccc3n2-c2ccc(F)cc2)cc1
InChIInChI=1S/C20H15FN2/c1-14-6-8-15(9-7-14)20-22-18-4-2-3-5-19(18)23(20)17-12-10-16(21)11-13-17/h2-13H,1H3
InChIKeyJHZIRCUQSOTJSZ-UHFFFAOYSA-N
XLogP5.14
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.35
LogP ≤ 55.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole
CID 134816858
1-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]benzimidazole
CID 18629889
2-[4-[4-[2,5-bis(4-methylphenyl)pyrrol-1-yl]phenyl]phenyl]-1-phenylbenzimidazole
CID 58489476
1-[4-[4,6-bis[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole
CID 152919581
2-[4-[4,6-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole
CID 155186062
2-[3,5-bis[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]-1-pyridin-4-ylbenzimidazole
CID 155179345
9-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 58470934
3,6-diphenyl-9-[4-(2-phenylbenzimidazol-1-yl)phenyl]carbazole
CID 123380544
4-methyl-N-[4-[4-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-N-(4-methylphenyl)aniline
CID 163796534
[4-(2-phenylbenzimidazol-1-yl)phenyl]phosphane
CID 174737756
2-(4-bromophenyl)-1-phenylbenzimidazole
CID 23094070
4-[2-(4-aminophenyl)benzimidazol-1-yl]phenol
CID 132528735

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole?
The IUPAC name of 1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole (CID 95930125) is 1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole.
What is the SMILES notation for 1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole?
The canonical SMILES for 1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole is Cc1ccc(-c2nc3ccccc3n2-c2ccc(F)cc2)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole?
The InChIKey is JHZIRCUQSOTJSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN2/c1-14-6-8-15(9-7-14)20-22-18-4-2-3-5-19(18)23(20)17-12-10-16(21)11-13-17/h2-13H,1H3.
What are the key properties of 1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole?
1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole has a molecular weight of 302.35 g/mol, XLogP of 5.14, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole is sourced from PubChem (CID 95930125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).