N-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide

C23H24ClN3O5S — CID 55574853

IUPACN-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(Oc2ccc(Cl)cc2)c(NC(=O)c2ccn(C)c(=O)c2)c1
InChIInChI=1S/C23H24ClN3O5S/c1-4-27(5-2)33(30,31)19-10-11-21(32-18-8-6-17(24)7-9-18)20(15-19)25-23(29)16-12-13-26(3)22(28)14-16/h6-15H,4-5H2,1-3H3,(H,25,29)
InChIKeyCUUKDSLCLFWOTQ-UHFFFAOYSA-N
MW489.98 g/mol
LogP4.11
Rot. Bonds8

About N-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide

N-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide (PubChem CID 55574853) has the molecular formula C23H24ClN3O5S and a molecular weight of 489.98 g/mol. Its IUPAC name is N-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide
PubChem CID55574853
Molecular FormulaC23H24ClN3O5S
Molecular Weight489.98 g/mol
Exact Mass489.11
IUPAC NameN-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(Oc2ccc(Cl)cc2)c(NC(=O)c2ccn(C)c(=O)c2)c1
InChIInChI=1S/C23H24ClN3O5S/c1-4-27(5-2)33(30,31)19-10-11-21(32-18-8-6-17(24)7-9-18)20(15-19)25-23(29)16-12-13-26(3)22(28)14-16/h6-15H,4-5H2,1-3H3,(H,25,29)
InChIKeyCUUKDSLCLFWOTQ-UHFFFAOYSA-N
XLogP4.11
TPSA97.71 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500489.98
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

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CID 34132202
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CID 30788927
3-(diethylsulfamoyl)-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]benzamide
CID 4003550
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-4-methoxybenzamide
CID 8501680
N-[5-(diethylsulfamoyl)-2-phenoxyphenyl]-2-methylsulfanylacetamide
CID 42997357
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-3,4,5-trimethoxybenzamide
CID 2913924
2-(4-chlorophenoxy)-N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2-methylpropanamide
CID 4881651
N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 55574013
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-4-iodobenzamide
CID 26901201
N-(2-bromo-4-chlorophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103774923
1-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-3-[2-(3,4-dichlorophenyl)cyclopentyl]urea
CID 167839292
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide
CID 7936803

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide (CID 55574853) is N-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide is CCN(CC)S(=O)(=O)c1ccc(Oc2ccc(Cl)cc2)c(NC(=O)c2ccn(C)c(=O)c2)c1.
What is the InChIKey of N-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide?
The InChIKey is CUUKDSLCLFWOTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24ClN3O5S/c1-4-27(5-2)33(30,31)19-10-11-21(32-18-8-6-17(24)7-9-18)20(15-19)25-23(29)16-12-13-26(3)22(28)14-16/h6-15H,4-5H2,1-3H3,(H,25,29).
What are the key properties of N-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide?
N-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide has a molecular weight of 489.98 g/mol, XLogP of 4.11, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-chlorophenoxy)-5-(diethylsulfamoyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 55574853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).