N,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide

C15H21N3O4S — CID 168717035

IUPACN,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide
SMILESCCN(CC)C(=O)c1cccc(N2CC(S(N)(=O)=O)CC2=O)c1
InChIInChI=1S/C15H21N3O4S/c1-3-17(4-2)15(20)11-6-5-7-12(8-11)18-10-13(9-14(18)19)23(16,21)22/h5-8,13H,3-4,9-10H2,1-2H3,(H2,16,21,22)
InChIKeyZGEISZJVMUCBNF-UHFFFAOYSA-N
MW339.42 g/mol
LogP0.56
Rot. Bonds5

About N,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide

N,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide (PubChem CID 168717035) has the molecular formula C15H21N3O4S and a molecular weight of 339.42 g/mol. Its IUPAC name is N,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide.

Molecular Properties

Compound NameN,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide
PubChem CID168717035
Molecular FormulaC15H21N3O4S
Molecular Weight339.42 g/mol
Exact Mass339.13
IUPAC NameN,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide
SMILESCCN(CC)C(=O)c1cccc(N2CC(S(N)(=O)=O)CC2=O)c1
InChIInChI=1S/C15H21N3O4S/c1-3-17(4-2)15(20)11-6-5-7-12(8-11)18-10-13(9-14(18)19)23(16,21)22/h5-8,13H,3-4,9-10H2,1-2H3,(H2,16,21,22)
InChIKeyZGEISZJVMUCBNF-UHFFFAOYSA-N
XLogP0.56
TPSA100.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.42
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide 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

1-(3-acetylphenyl)-5-oxopyrrolidine-3-sulfonamide
CID 168716979
1-[4-(diethylcarbamoyl)phenyl]-5-oxopyrrolidine-3-sulfonyl chloride
CID 168711191
1-(3-ethoxyphenyl)-5-oxopyrrolidine-3-sulfonamide
CID 168717122
N-[3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)phenyl]acetamide
CID 168716959
1-[3-(2-methylprop-2-enoxy)phenyl]-5-oxopyrrolidine-3-sulfonamide
CID 168716937
N-ethyl-4-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide
CID 168717045
5-oxo-1-(3-piperidin-1-ylphenyl)pyrrolidine-3-sulfonamide
CID 168719420
3-(4-amino-2-oxopyrrolidin-1-yl)-N,N-dimethylbenzamide
CID 168699354
5-oxo-1-[3-(pyrrolidin-1-ylmethyl)phenyl]pyrrolidine-3-sulfonamide
CID 168719381
3-[4-(bromomethyl)-2-oxopyrrolidin-1-yl]-N,N-dimethylbenzamide
CID 168503934
[1-[3-(hydrazinecarbonyl)phenyl]-5-oxopyrrolidin-3-yl]methanesulfonamide
CID 168683124
1-[6-(diethylamino)-3-pyridinyl]-5-oxopyrrolidine-3-sulfonamide
CID 168717038

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide?
The IUPAC name of N,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide (CID 168717035) is N,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide.
What is the SMILES notation for N,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide?
The canonical SMILES for N,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide is CCN(CC)C(=O)c1cccc(N2CC(S(N)(=O)=O)CC2=O)c1.
What is the InChIKey of N,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide?
The InChIKey is ZGEISZJVMUCBNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O4S/c1-3-17(4-2)15(20)11-6-5-7-12(8-11)18-10-13(9-14(18)19)23(16,21)22/h5-8,13H,3-4,9-10H2,1-2H3,(H2,16,21,22).
What are the key properties of N,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide?
N,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide has a molecular weight of 339.42 g/mol, XLogP of 0.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-(2-oxo-4-sulfamoylpyrrolidin-1-yl)benzamide is sourced from PubChem (CID 168717035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).