1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide

C22H22ClN3O — CID 22285546

IUPAC1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide
SMILESO=C(NC1CCCCC1)c1cn(-c2ccc(Cl)cc2)c(-c2ccccc2)n1
InChIInChI=1S/C22H22ClN3O/c23-17-11-13-19(14-12-17)26-15-20(22(27)24-18-9-5-2-6-10-18)25-21(26)16-7-3-1-4-8-16/h1,3-4,7-8,11-15,18H,2,5-6,9-10H2,(H,24,27)
InChIKeyDASFMUKQHMITOG-UHFFFAOYSA-N
MW379.89 g/mol
LogP5.26
Rot. Bonds4

About 1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide

1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide (PubChem CID 22285546) has the molecular formula C22H22ClN3O and a molecular weight of 379.89 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide
PubChem CID22285546
Molecular FormulaC22H22ClN3O
Molecular Weight379.89 g/mol
Exact Mass379.15
IUPAC Name1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide
SMILESO=C(NC1CCCCC1)c1cn(-c2ccc(Cl)cc2)c(-c2ccccc2)n1
InChIInChI=1S/C22H22ClN3O/c23-17-11-13-19(14-12-17)26-15-20(22(27)24-18-9-5-2-6-10-18)25-21(26)16-7-3-1-4-8-16/h1,3-4,7-8,11-15,18H,2,5-6,9-10H2,(H,24,27)
InChIKeyDASFMUKQHMITOG-UHFFFAOYSA-N
XLogP5.26
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.89
LogP ≤ 55.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-Chlorophenyl)-6-(4-piperidinyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 46175113
(1-Benzyl-1h-Imidazol-4-Yl)[4-(2-Chlorophenyl)piperazin-1-Yl]methanone
CID 74983356
1-(4-Chloro-phenyl)-2-(2,4-dichloro-phenyl)-5-methyl-1H-imidazole-4-carboxylic acid cyclohexylamide
CID 10195347
1-(4-Chloro-phenyl)-2-(2,4-dichloro-phenyl)-5-methyl-1H-imidazole-4-carboxylic acid cycloheptylamide
CID 11306088
N-(2-bicyclo[2.2.1]heptanyl)-1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-5-methylimidazole-4-carboxamide
CID 21949054
7-chloro-2-ethyl-N-[[4-(4-methylphenyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 53469219
6-chloro-2-ethyl-N-[[4-(4-methylphenyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 68234858
N-[4-[4-(2-chloro-3-ethylphenyl)piperazin-1-yl]butyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 130431343
MtTMPK-IN-7
CID 154573942
4-(5-{[1-(4-Chloro-phenyl)-2-oxo-pyrrolidin-3-ylamino]-methyl}-imidazol-1-ylmethyl)-benzonitrile
CID 9844227
2-(2-chlorophenyl)-1-(4-chlorophenyl)-N-((1S,2S)-2-hydroxycyclopentyl)-1H-imidazole-4-carboxamide
CID 10112572
1-(4-Chloro-phenyl)-2-(2,4-dichloro-phenyl)-5-methyl-1H-imidazole-4-carboxylic acid cyclopentylamide
CID 10127496

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide?
The IUPAC name of 1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide (CID 22285546) is 1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide.
What is the SMILES notation for 1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide?
The canonical SMILES for 1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide is O=C(NC1CCCCC1)c1cn(-c2ccc(Cl)cc2)c(-c2ccccc2)n1.
What is the InChIKey of 1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide?
The InChIKey is DASFMUKQHMITOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22ClN3O/c23-17-11-13-19(14-12-17)26-15-20(22(27)24-18-9-5-2-6-10-18)25-21(26)16-7-3-1-4-8-16/h1,3-4,7-8,11-15,18H,2,5-6,9-10H2,(H,24,27).
What are the key properties of 1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide?
1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide has a molecular weight of 379.89 g/mol, XLogP of 5.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-cyclohexyl-2-phenylimidazole-4-carboxamide is sourced from PubChem (CID 22285546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).