N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide

C20H22N2O4S — CID 39942601

IUPACN-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide
SMILESCCCS(=O)(=O)c1ccccc1C(=O)Nc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C20H22N2O4S/c1-2-14-27(25,26)18-7-4-3-6-17(18)20(24)21-15-9-11-16(12-10-15)22-13-5-8-19(22)23/h3-4,6-7,9-12H,2,5,8,13-14H2,1H3,(H,21,24)
InChIKeySWITYSNLEVQPJL-UHFFFAOYSA-N
MW386.47 g/mol
LogP3.25
Rot. Bonds6

About N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide

N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide (PubChem CID 39942601) has the molecular formula C20H22N2O4S and a molecular weight of 386.47 g/mol. Its IUPAC name is N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide.

Molecular Properties

Compound NameN-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide
PubChem CID39942601
Molecular FormulaC20H22N2O4S
Molecular Weight386.47 g/mol
Exact Mass386.13
IUPAC NameN-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide
SMILESCCCS(=O)(=O)c1ccccc1C(=O)Nc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C20H22N2O4S/c1-2-14-27(25,26)18-7-4-3-6-17(18)20(24)21-15-9-11-16(12-10-15)22-13-5-8-19(22)23/h3-4,6-7,9-12H,2,5,8,13-14H2,1H3,(H,21,24)
InChIKeySWITYSNLEVQPJL-UHFFFAOYSA-N
XLogP3.25
TPSA83.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.47
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide 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

2-(difluoromethylsulfonyl)-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 71806479
2-chloro-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686374
2-methoxy-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686423
N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide
CID 7687294
3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 92673482
N-(4-ethylsulfonylphenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 39862925
2-[(4-chlorophenyl)sulfonylamino]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 35893819
2-[benzenesulfonyl(benzyl)amino]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 28637305
N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 7686436
2-[2-oxo-2-[4-(2-oxopyrrolidin-1-yl)anilino]ethoxy]-N-phenylbenzamide
CID 17419102
N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide
CID 17225015
N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide
CID 38715443

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide?
The IUPAC name of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide (CID 39942601) is N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide.
What is the SMILES notation for N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide?
The canonical SMILES for N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide is CCCS(=O)(=O)c1ccccc1C(=O)Nc1ccc(N2CCCC2=O)cc1.
What is the InChIKey of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide?
The InChIKey is SWITYSNLEVQPJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O4S/c1-2-14-27(25,26)18-7-4-3-6-17(18)20(24)21-15-9-11-16(12-10-15)22-13-5-8-19(22)23/h3-4,6-7,9-12H,2,5,8,13-14H2,1H3,(H,21,24).
What are the key properties of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide?
N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide has a molecular weight of 386.47 g/mol, XLogP of 3.25, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide is sourced from PubChem (CID 39942601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).