2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole

C16H10ClF3N2 — CID 18673143

IUPAC2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole
SMILESFC(F)(F)c1cccc(C2(c3ccc(Cl)cc3)N=CC=N2)c1
InChIInChI=1S/C16H10ClF3N2/c17-14-6-4-11(5-7-14)15(21-8-9-22-15)12-2-1-3-13(10-12)16(18,19)20/h1-10H
InChIKeyQVBMDYAFMXBBNF-UHFFFAOYSA-N
MW322.72 g/mol
LogP4.72
Rot. Bonds2

About 2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole

2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole (PubChem CID 18673143) has the molecular formula C16H10ClF3N2 and a molecular weight of 322.72 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole.

Molecular Properties

Compound Name2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole
PubChem CID18673143
Molecular FormulaC16H10ClF3N2
Molecular Weight322.72 g/mol
Exact Mass322.05
IUPAC Name2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole
SMILESFC(F)(F)c1cccc(C2(c3ccc(Cl)cc3)N=CC=N2)c1
InChIInChI=1S/C16H10ClF3N2/c17-14-6-4-11(5-7-14)15(21-8-9-22-15)12-2-1-3-13(10-12)16(18,19)20/h1-10H
InChIKeyQVBMDYAFMXBBNF-UHFFFAOYSA-N
XLogP4.72
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.72
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenyl)-5-(2,6-difluorophenyl)-3-methyl-3,4-dihydro-2H-pyrrole
CID 12979398
(4-Chlorophenyl)[3-(trifluoromethyl)phenyl]methanamine
CID 21528797
5-(4-chlorophenyl)-2-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole
CID 58915218
2-(4-chlorophenyl)-5-(2,6-difluorophenyl)-3,4-dihydro-2H-pyrrole
CID 60076639
N-(3,5-bis(trifluoromethyl)benzylidene)(2-chloro-5-(trifluoromethyl)phenyl)methanamine
CID 86614963
2-[4-chloro-3-(trifluoromethyl)phenyl]-3,4,5,6-tetrahydro-2H-azepine
CID 91556476
N-[(4-chlorophenyl)methyl]-1-(2,6-difluorophenyl)methanimine
CID 102479660
3-[2-[(4-Chlorophenyl)methylimino]ethylideneamino]-1-(3,5-difluorophenyl)butan-2-amine
CID 123786233
4-(3,5-Dichlorophenyl)-2-(3-methylphenyl)-4-(trifluoromethyl)-2,3-dihydropyrrole
CID 141305931
5-(2-chlorophenyl)-2-[4-fluoro-3-(fluoromethyl)phenyl]-3,4-dihydro-2H-pyrrole
CID 142175421
1-Chloro-4-[isocyanato(phenyl)methyl]-2-(trifluoromethyl)benzene
CID 150438543
2-(4-Chlorophenyl)-2-(trifluoromethyl)imidazole
CID 174409445

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole?
The IUPAC name of 2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole (CID 18673143) is 2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole.
What is the SMILES notation for 2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole?
The canonical SMILES for 2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole is FC(F)(F)c1cccc(C2(c3ccc(Cl)cc3)N=CC=N2)c1.
What is the InChIKey of 2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole?
The InChIKey is QVBMDYAFMXBBNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClF3N2/c17-14-6-4-11(5-7-14)15(21-8-9-22-15)12-2-1-3-13(10-12)16(18,19)20/h1-10H.
What are the key properties of 2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole?
2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole has a molecular weight of 322.72 g/mol, XLogP of 4.72, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]imidazole is sourced from PubChem (CID 18673143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).