5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide

C24H21Cl3N2O — CID 10217134

IUPAC5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide
SMILESO=C(NC1CCCCC1)c1cnc(-c2ccc(Cl)cc2Cl)c(-c2ccc(Cl)cc2)c1
InChIInChI=1S/C24H21Cl3N2O/c25-17-8-6-15(7-9-17)21-12-16(24(30)29-19-4-2-1-3-5-19)14-28-23(21)20-11-10-18(26)13-22(20)27/h6-14,19H,1-5H2,(H,29,30)
InChIKeyHWWUYYDPBSOWDC-UHFFFAOYSA-N
MW459.80 g/mol
LogP7.44
Rot. Bonds4

About 5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide

5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide (PubChem CID 10217134) has the molecular formula C24H21Cl3N2O and a molecular weight of 459.80 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide
PubChem CID10217134
Molecular FormulaC24H21Cl3N2O
Molecular Weight459.80 g/mol
Exact Mass458.07
IUPAC Name5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide
SMILESO=C(NC1CCCCC1)c1cnc(-c2ccc(Cl)cc2Cl)c(-c2ccc(Cl)cc2)c1
InChIInChI=1S/C24H21Cl3N2O/c25-17-8-6-15(7-9-17)21-12-16(24(30)29-19-4-2-1-3-5-19)14-28-23(21)20-11-10-18(26)13-22(20)27/h6-14,19H,1-5H2,(H,29,30)
InChIKeyHWWUYYDPBSOWDC-UHFFFAOYSA-N
XLogP7.44
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500459.80
LogP ≤ 57.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Boscalid
CID 213013
N-[2-(4-chlorophenyl)phenyl]pyridine-3-carboxamide
CID 67120985
5,6-bis(4-chlorophenyl)-N-cyclohexylpyrazine-2-carboxamide
CID 10173396
N4-benzyl-2-chloro-N1-(4-chloro-3-(pyridin-2-yl)phenyl)terephthalamide
CID 52942245
N-[2-(4-chlorophenyl)ethyl]pyridine-3-carboxamide
CID 571790
N-benzyl-5-(4-chlorophenyl)nicotinamide
CID 46032908
5-(4-chlorophenyl)-N-(2-methylbenzyl)nicotinamide
CID 52945923
N-(2-chlorobenzyl)-5-(4-chlorophenyl)nicotinamide
CID 52948346
5,6-Diaryl-pyrazine-2-amide derivative, 6e
CID 10216582
N-[4-(2-Chloro-benzoylamino)-phenyl]-nicotinamide
CID 1124627
5-(4-Chloro-phenyl)-6-(2,4-dichloro-phenyl)-pyridine-2-carboxylic acid cyclopentylamide
CID 10127451
5-(4-Chloro-phenyl)-6-(2,4-dichloro-phenyl)-N-piperidin-1-yl-nicotinamide
CID 10127677

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide?
The IUPAC name of 5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide (CID 10217134) is 5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide is O=C(NC1CCCCC1)c1cnc(-c2ccc(Cl)cc2Cl)c(-c2ccc(Cl)cc2)c1.
What is the InChIKey of 5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide?
The InChIKey is HWWUYYDPBSOWDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21Cl3N2O/c25-17-8-6-15(7-9-17)21-12-16(24(30)29-19-4-2-1-3-5-19)14-28-23(21)20-11-10-18(26)13-22(20)27/h6-14,19H,1-5H2,(H,29,30).
What are the key properties of 5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide?
5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide has a molecular weight of 459.80 g/mol, XLogP of 7.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-N-cyclohexyl-6-(2,4-dichlorophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 10217134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).