N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide

C22H25N3O4S — CID 55756401

IUPACN-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(CNC(=O)c2cc(=O)n(C)c3ccccc23)cc1
InChIInChI=1S/C22H25N3O4S/c1-4-25(5-2)30(28,29)17-12-10-16(11-13-17)15-23-22(27)19-14-21(26)24(3)20-9-7-6-8-18(19)20/h6-14H,4-5,15H2,1-3H3,(H,23,27)
InChIKeyGXFFGXLXTURQST-UHFFFAOYSA-N
MW427.53 g/mol
LogP2.50
Rot. Bonds7

About N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide

N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide (PubChem CID 55756401) has the molecular formula C22H25N3O4S and a molecular weight of 427.53 g/mol. Its IUPAC name is N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide.

Molecular Properties

Compound NameN-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide
PubChem CID55756401
Molecular FormulaC22H25N3O4S
Molecular Weight427.53 g/mol
Exact Mass427.16
IUPAC NameN-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(CNC(=O)c2cc(=O)n(C)c3ccccc23)cc1
InChIInChI=1S/C22H25N3O4S/c1-4-25(5-2)30(28,29)17-12-10-16(11-13-17)15-23-22(27)19-14-21(26)24(3)20-9-7-6-8-18(19)20/h6-14H,4-5,15H2,1-3H3,(H,23,27)
InChIKeyGXFFGXLXTURQST-UHFFFAOYSA-N
XLogP2.50
TPSA88.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.53
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-benzyl-1-methyl-2-oxoquinoline-4-carboxamide
CID 110694467
1-methyl-N-[(4-methylphenyl)methyl]-2-oxoquinoline-4-carboxamide
CID 110694470
3-bromo-N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methylindole-2-carboxamide
CID 55789645
N-benzyl-2-chloro-5-(diethylsulfamoyl)benzamide
CID 1121797
N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-dimethylbenzamide
CID 9474464
1-benzyl-3-[[4-(diethylsulfamoyl)phenyl]methyl]urea
CID 41249851
N-[[4-(diethylsulfamoyl)phenyl]methyl]-1H-indazole-3-carboxamide
CID 9269012
N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide
CID 26423277
N-[[4-(diethylsulfamoyl)phenyl]methyl]-3-fluorobenzamide
CID 7603385
N-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide
CID 110694477
N-[[4-(diethylsulfamoyl)phenyl]methyl]-2-(3-methoxyphenyl)acetamide
CID 26423088
5-(diethylsulfamoyl)-1-methyl-N-[(4-methylphenyl)methyl]indole-2-carboxamide
CID 50802016

Frequently Asked Questions

What is the IUPAC name of N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide?
The IUPAC name of N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide (CID 55756401) is N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide.
What is the SMILES notation for N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide?
The canonical SMILES for N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide is CCN(CC)S(=O)(=O)c1ccc(CNC(=O)c2cc(=O)n(C)c3ccccc23)cc1.
What is the InChIKey of N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide?
The InChIKey is GXFFGXLXTURQST-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O4S/c1-4-25(5-2)30(28,29)17-12-10-16(11-13-17)15-23-22(27)19-14-21(26)24(3)20-9-7-6-8-18(19)20/h6-14H,4-5,15H2,1-3H3,(H,23,27).
What are the key properties of N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide?
N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide has a molecular weight of 427.53 g/mol, XLogP of 2.50, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-methyl-2-oxoquinoline-4-carboxamide is sourced from PubChem (CID 55756401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).