2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide

C23H24Cl2N4O — CID 10114327

IUPAC2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide
SMILESCCc1c(C(=O)NN2CCCCC2)nc(-c2ccccc2Cl)n1-c1ccc(Cl)cc1
InChIInChI=1S/C23H24Cl2N4O/c1-2-20-21(23(30)27-28-14-6-3-7-15-28)26-22(18-8-4-5-9-19(18)25)29(20)17-12-10-16(24)11-13-17/h4-5,8-13H,2-3,6-7,14-15H2,1H3,(H,27,30)
InChIKeyWIUAZKNCWYGPFK-UHFFFAOYSA-N
MW443.38 g/mol
LogP5.54
Rot. Bonds5

About 2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide

2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide (PubChem CID 10114327) has the molecular formula C23H24Cl2N4O and a molecular weight of 443.38 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide
PubChem CID10114327
Molecular FormulaC23H24Cl2N4O
Molecular Weight443.38 g/mol
Exact Mass442.13
IUPAC Name2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide
SMILESCCc1c(C(=O)NN2CCCCC2)nc(-c2ccccc2Cl)n1-c1ccc(Cl)cc1
InChIInChI=1S/C23H24Cl2N4O/c1-2-20-21(23(30)27-28-14-6-3-7-15-28)26-22(18-8-4-5-9-19(18)25)29(20)17-12-10-16(24)11-13-17/h4-5,8-13H,2-3,6-7,14-15H2,1H3,(H,27,30)
InChIKeyWIUAZKNCWYGPFK-UHFFFAOYSA-N
XLogP5.54
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500443.38
LogP ≤ 55.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-5-methylsulfonyl-N-(piperidin-1-yl)-1H-imidazole-4-carboxamide
CID 11555526
1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-5-(methylthio)-N-(pyrrolidin-1-yl)-1H-imidazole-4-carboxamide
CID 46889224
1-(4-Chlorophenyl)-2-(2,4-dichlorophenyl)-5-(methylsulfinyl)-N-(piperidin-1-YL)-1H-imidazole-4-carboxamide (enantiomeric mix)
CID 23654364
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
1-(4-Chloro-phenyl)-2-(2,4-dichloro-phenyl)-5-ethyl-1H-imidazole-4-carboxylic acid piperidin-1-ylamide
CID 11408950
1-(4-Chloro-phenyl)-2-(2,4-dichloro-phenyl)-5-methyl-1H-imidazole-4-carboxylic acid (hexahydro-cyclopenta[c]pyrrol-2-yl)-amide
CID 21949023
1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-5-methylsulfanyl-N-(piperidin-1-yl)-1H-imidazole-4-carboxamide
CID 21949029
N-[(E)-1-(4-chlorophenyl)propylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 6060729
1-(4-Chloro-phenyl)-2-(2,4-dichloro-phenyl)-5-methyl-1H-imidazole-4-carboxylic acid cyclopentylamide
CID 10127496
N-(Piperidin-1-yl)-4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-1-methylimidazole-2-carboxamide
CID 10183243
1-(4-Chloro-phenyl)-2-(2,4-dichloro-phenyl)-5-methyl-1H-imidazole-4-carboxylic acid morpholin-4-ylamide
CID 10195397

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide?
The IUPAC name of 2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide (CID 10114327) is 2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide.
What is the SMILES notation for 2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide?
The canonical SMILES for 2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide is CCc1c(C(=O)NN2CCCCC2)nc(-c2ccccc2Cl)n1-c1ccc(Cl)cc1.
What is the InChIKey of 2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide?
The InChIKey is WIUAZKNCWYGPFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24Cl2N4O/c1-2-20-21(23(30)27-28-14-6-3-7-15-28)26-22(18-8-4-5-9-19(18)25)29(20)17-12-10-16(24)11-13-17/h4-5,8-13H,2-3,6-7,14-15H2,1H3,(H,27,30).
What are the key properties of 2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide?
2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide has a molecular weight of 443.38 g/mol, XLogP of 5.54, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-N-piperidin-1-ylimidazole-4-carboxamide is sourced from PubChem (CID 10114327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).