N,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide

C19H21N3O4S — CID 24580878

IUPACN,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide
SMILESCN(C)C(=O)c1ccc(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1
InChIInChI=1S/C19H21N3O4S/c1-21(2)19(24)14-5-7-15(8-6-14)20-27(25,26)17-11-9-16(10-12-17)22-13-3-4-18(22)23/h5-12,20H,3-4,13H2,1-2H3
InChIKeyKSGKJDUEUQPDIZ-UHFFFAOYSA-N
MW387.46 g/mol
LogP2.32
Rot. Bonds5

About N,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide

N,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide (PubChem CID 24580878) has the molecular formula C19H21N3O4S and a molecular weight of 387.46 g/mol. Its IUPAC name is N,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide
PubChem CID24580878
Molecular FormulaC19H21N3O4S
Molecular Weight387.46 g/mol
Exact Mass387.13
IUPAC NameN,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide
SMILESCN(C)C(=O)c1ccc(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1
InChIInChI=1S/C19H21N3O4S/c1-21(2)19(24)14-5-7-15(8-6-14)20-27(25,26)17-11-9-16(10-12-17)22-13-3-4-18(22)23/h5-12,20H,3-4,13H2,1-2H3
InChIKeyKSGKJDUEUQPDIZ-UHFFFAOYSA-N
XLogP2.32
TPSA86.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.46
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-oxopyrrolidin-1-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzenesulfonamide
CID 8823939
N-methyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfamoyl]benzamide
CID 26781606
4-(2-oxopyrrolidin-1-yl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzenesulfonamide
CID 24656653
N-(4-methylsulfonylphenyl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 8823223
4-[[4-(dimethylcarbamoyl)phenyl]sulfamoyl]benzoic acid
CID 24580861
N-(4-chlorophenyl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 8822397
4-(benzenesulfonamido)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 28578210
N,N-dimethyl-4-[(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylamino]benzamide
CID 24580834
N-[4-(2-oxopiperidin-1-yl)phenyl]benzenesulfonamide
CID 7636091
[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 4-(2-oxopyrrolidin-1-yl)benzoate
CID 7953022
N-(4-butylphenyl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 8822486
4-[(4-chlorophenyl)sulfamoyl]-N,N-dimethylbenzamide
CID 7971137

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide?
The IUPAC name of N,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide (CID 24580878) is N,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide.
What is the SMILES notation for N,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide?
The canonical SMILES for N,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide is CN(C)C(=O)c1ccc(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1.
What is the InChIKey of N,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide?
The InChIKey is KSGKJDUEUQPDIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O4S/c1-21(2)19(24)14-5-7-15(8-6-14)20-27(25,26)17-11-9-16(10-12-17)22-13-3-4-18(22)23/h5-12,20H,3-4,13H2,1-2H3.
What are the key properties of N,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide?
N,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide has a molecular weight of 387.46 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzamide is sourced from PubChem (CID 24580878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).