2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole

C22H17FN2 — CID 71600894

IUPAC2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole
SMILESCn1c(-c2ccc(F)cc2)nc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C22H17FN2/c1-25-21(17-10-6-3-7-11-17)20(16-8-4-2-5-9-16)24-22(25)18-12-14-19(23)15-13-18/h2-15H,1H3
InChIKeyYRWCHQQXMDDZOQ-UHFFFAOYSA-N
MW328.39 g/mol
LogP5.56
Rot. Bonds3

About 2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole

2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole (PubChem CID 71600894) has the molecular formula C22H17FN2 and a molecular weight of 328.39 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole
PubChem CID71600894
Molecular FormulaC22H17FN2
Molecular Weight328.39 g/mol
Exact Mass328.14
IUPAC Name2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole
SMILESCn1c(-c2ccc(F)cc2)nc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C22H17FN2/c1-25-21(17-10-6-3-7-11-17)20(16-8-4-2-5-9-16)24-22(25)18-12-14-19(23)15-13-18/h2-15H,1H3
InChIKeyYRWCHQQXMDDZOQ-UHFFFAOYSA-N
XLogP5.56
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.39
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,4,5-Triphenylimidazole
CID 10232
4,5-Diphenyl-2-methylimidazole
CID 236696
1-benzyl-5-phenyl-1H-imidazole
CID 10444038
1H-Benzimidazole, 2-(2,6-difluorophenyl)-1-((2,6-difluorophenyl)methyl)-
CID 468847
1-(2,6-Difluorobenzyl)-2-(2,6-difluorophenyl)-4-methyl-1h-benzimidazole
CID 468848
1-(2,6-Difluorobenzyl)-2-(2,6-difluorophenyl)-4-ethylbenzimidazole
CID 492674
1-Benzyl-2-methylbenzimidazole
CID 759305
4-(4,5-Diphenyl-1H-imidazol-2-yl)-N,N-dimethylaniline
CID 237339
1,2-dibenzyl-1H-1,3-benzodiazole
CID 1350539
1-Benzyl-2-phenylbenzimidazole
CID 1221687
1-(4-Fluorobenzyl)-5-phenyl-1H-imidazole
CID 45103808
2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]-N,N-dimethyl-benzimidazol-4-amine
CID 492678

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole?
The IUPAC name of 2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole (CID 71600894) is 2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole.
What is the SMILES notation for 2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole?
The canonical SMILES for 2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole is Cn1c(-c2ccc(F)cc2)nc(-c2ccccc2)c1-c1ccccc1.
What is the InChIKey of 2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole?
The InChIKey is YRWCHQQXMDDZOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17FN2/c1-25-21(17-10-6-3-7-11-17)20(16-8-4-2-5-9-16)24-22(25)18-12-14-19(23)15-13-18/h2-15H,1H3.
What are the key properties of 2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole?
2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole has a molecular weight of 328.39 g/mol, XLogP of 5.56, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1-methyl-4,5-diphenylimidazole is sourced from PubChem (CID 71600894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).