1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide

C63H57Cl4N7O9S — CID 87957821

IUPAC1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccc(C)n(-c3ccc(C)c(Cl)c3)c2=O)cc1.Cc1ccc(-n2c(C)ccc(C(=O)NCc3ccc(Cl)cc3)c2=O)cc1Cl.Cc1ccc(C(=O)NCc2ccc(S(N)(=O)=O)cc2)c(=O)n1-c1cccc(Cl)c1
InChIInChI=1S/C22H21ClN2O3.C21H18Cl2N2O2.C20H18ClN3O4S/c1-14-4-8-17(12-20(14)23)25-15(2)5-11-19(22(25)27)21(26)24-13-16-6-9-18(28-3)10-7-16;1-13-3-9-17(11-19(13)23)25-14(2)4-10-18(21(25)27)20(26)24-12-15-5-7-16(22)8-6-15;1-13-5-10-18(20(26)24(13)16-4-2-3-15(21)11-16)19(25)23-12-14-6-8-17(9-7-14)29(22,27)28/h4-12H,13H2,1-3H3,(H,24,26);3-11H,12H2,1-2H3,(H,24,26);2-11H,12H2,1H3,(H,23,25)(H2,22,27,28)
InChIKeyBIWFYXGYZXRIKQ-UHFFFAOYSA-N
MW1230.07 g/mol
LogP11.11
Rot. Bonds14

About 1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide

1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide (PubChem CID 87957821) has the molecular formula C63H57Cl4N7O9S and a molecular weight of 1230.07 g/mol. Its IUPAC name is 1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide
PubChem CID87957821
Molecular FormulaC63H57Cl4N7O9S
Molecular Weight1230.07 g/mol
Exact Mass1227.27
IUPAC Name1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccc(C)n(-c3ccc(C)c(Cl)c3)c2=O)cc1.Cc1ccc(-n2c(C)ccc(C(=O)NCc3ccc(Cl)cc3)c2=O)cc1Cl.Cc1ccc(C(=O)NCc2ccc(S(N)(=O)=O)cc2)c(=O)n1-c1cccc(Cl)c1
InChIInChI=1S/C22H21ClN2O3.C21H18Cl2N2O2.C20H18ClN3O4S/c1-14-4-8-17(12-20(14)23)25-15(2)5-11-19(22(25)27)21(26)24-13-16-6-9-18(28-3)10-7-16;1-13-3-9-17(11-19(13)23)25-14(2)4-10-18(21(25)27)20(26)24-12-15-5-7-16(22)8-6-15;1-13-5-10-18(20(26)24(13)16-4-2-3-15(21)11-16)19(25)23-12-14-6-8-17(9-7-14)29(22,27)28/h4-12H,13H2,1-3H3,(H,24,26);3-11H,12H2,1-2H3,(H,24,26);2-11H,12H2,1H3,(H,23,25)(H2,22,27,28)
InChIKeyBIWFYXGYZXRIKQ-UHFFFAOYSA-N
XLogP11.11
TPSA222.69 Ų
H-Bond Donors4
H-Bond Acceptors12
Rotatable Bonds14
Heavy Atoms84
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001230.07
LogP ≤ 511.11
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1012

Analyze 1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide with MolForge

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Related Compounds

2,4-dichloro-N-[(4-methoxyphenyl)methyl]benzamide
CID 779696
4-methoxy-N-[(4-sulfamoylphenyl)methyl]benzamide
CID 3581074
2-methoxy-4,5-dimethyl-N-[(4-sulfamoylphenyl)methyl]benzamide
CID 110761535
1-(4-methoxyphenyl)-2,5-dimethyl-N-[(4-methylsulfonylphenyl)methyl]pyrrole-3-carboxamide
CID 55961916
1-(3-chloro-4-methylphenyl)-6-methyl-2-oxopyridine-3-carboxylic acid
CID 82124199
4-methoxy-2,3-dimethyl-N-[(4-sulfamoylphenyl)methyl]benzamide
CID 110763175
2-chloro-4-methoxy-N-[(4-methoxyphenyl)methyl]benzamide
CID 110763493
3,5-dimethoxy-N-[(4-sulfamoylphenyl)methyl]benzamide
CID 1011870
4-chloro-2-(2-oxopyrrolidin-1-yl)-N-[(4-sulfamoylphenyl)methyl]benzamide
CID 42889160
N-[(4-sulfamoylphenyl)methyl]naphthalene-1-carboxamide
CID 4125317
N-[[4-(difluoromethoxy)phenyl]methyl]-2-methyl-5-sulfamoylbenzamide
CID 42010369
2,3,4-trifluoro-N-[(4-sulfamoylphenyl)methyl]benzamide
CID 17248737

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide?
The IUPAC name of 1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide (CID 87957821) is 1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide is COc1ccc(CNC(=O)c2ccc(C)n(-c3ccc(C)c(Cl)c3)c2=O)cc1.Cc1ccc(-n2c(C)ccc(C(=O)NCc3ccc(Cl)cc3)c2=O)cc1Cl.Cc1ccc(C(=O)NCc2ccc(S(N)(=O)=O)cc2)c(=O)n1-c1cccc(Cl)c1.
What is the InChIKey of 1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide?
The InChIKey is BIWFYXGYZXRIKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21ClN2O3.C21H18Cl2N2O2.C20H18ClN3O4S/c1-14-4-8-17(12-20(14)23)25-15(2)5-11-19(22(25)27)21(26)24-13-16-6-9-18(28-3)10-7-16;1-13-3-9-17(11-19(13)23)25-14(2)4-10-18(21(25)27)20(26)24-12-15-5-7-16(22)8-6-15;1-13-5-10-18(20(26)24(13)16-4-2-3-15(21)11-16)19(25)23-12-14-6-8-17(9-7-14)29(22,27)28/h4-12H,13H2,1-3H3,(H,24,26);3-11H,12H2,1-2H3,(H,24,26);2-11H,12H2,1H3,(H,23,25)(H2,22,27,28).
What are the key properties of 1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide?
1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide has a molecular weight of 1230.07 g/mol, XLogP of 11.11, 14 rotatable bonds, 4 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-4-methylphenyl)-N-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chloro-4-methylphenyl)-N-[(4-methoxyphenyl)methyl]-6-methyl-2-oxopyridine-3-carboxamide;1-(3-chlorophenyl)-6-methyl-2-oxo-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 87957821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).