1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole

C15H8ClF3N2 — CID 66897597

IUPAC1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole
SMILESFc1cc(F)c(-c2cncn2-c2ccc(Cl)cc2)c(F)c1
InChIInChI=1S/C15H8ClF3N2/c16-9-1-3-11(4-2-9)21-8-20-7-14(21)15-12(18)5-10(17)6-13(15)19/h1-8H
InChIKeyGPAYTARFYIFWKR-UHFFFAOYSA-N
MW308.69 g/mol
LogP4.61
Rot. Bonds2

About 1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole

1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole (PubChem CID 66897597) has the molecular formula C15H8ClF3N2 and a molecular weight of 308.69 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole.

Molecular Properties

Compound Name1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole
PubChem CID66897597
Molecular FormulaC15H8ClF3N2
Molecular Weight308.69 g/mol
Exact Mass308.03
IUPAC Name1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole
SMILESFc1cc(F)c(-c2cncn2-c2ccc(Cl)cc2)c(F)c1
InChIInChI=1S/C15H8ClF3N2/c16-9-1-3-11(4-2-9)21-8-20-7-14(21)15-12(18)5-10(17)6-13(15)19/h1-8H
InChIKeyGPAYTARFYIFWKR-UHFFFAOYSA-N
XLogP4.61
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.69
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole?
The IUPAC name of 1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole (CID 66897597) is 1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole.
What is the SMILES notation for 1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole?
The canonical SMILES for 1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole is Fc1cc(F)c(-c2cncn2-c2ccc(Cl)cc2)c(F)c1.
What is the InChIKey of 1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole?
The InChIKey is GPAYTARFYIFWKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8ClF3N2/c16-9-1-3-11(4-2-9)21-8-20-7-14(21)15-12(18)5-10(17)6-13(15)19/h1-8H.
What are the key properties of 1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole?
1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole has a molecular weight of 308.69 g/mol, XLogP of 4.61, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-5-(2,4,6-trifluorophenyl)imidazole is sourced from PubChem (CID 66897597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).