5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide

C19H23N3O3S — CID 17453519

IUPAC5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide
SMILESCN(C)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)Nc2ccccc2)c1
InChIInChI=1S/C19H23N3O3S/c1-21(2)26(24,25)16-10-11-18(22-12-6-7-13-22)17(14-16)19(23)20-15-8-4-3-5-9-15/h3-5,8-11,14H,6-7,12-13H2,1-2H3,(H,20,23)
InChIKeyNATUFGGKBOORCW-UHFFFAOYSA-N
MW373.48 g/mol
LogP2.79
Rot. Bonds5

About 5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide

5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide (PubChem CID 17453519) has the molecular formula C19H23N3O3S and a molecular weight of 373.48 g/mol. Its IUPAC name is 5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide.

Molecular Properties

Compound Name5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide
PubChem CID17453519
Molecular FormulaC19H23N3O3S
Molecular Weight373.48 g/mol
Exact Mass373.15
IUPAC Name5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide
SMILESCN(C)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)Nc2ccccc2)c1
InChIInChI=1S/C19H23N3O3S/c1-21(2)26(24,25)16-10-11-18(22-12-6-7-13-22)17(14-16)19(23)20-15-8-4-3-5-9-15/h3-5,8-11,14H,6-7,12-13H2,1-2H3,(H,20,23)
InChIKeyNATUFGGKBOORCW-UHFFFAOYSA-N
XLogP2.79
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N,N-dimethyl-4-(pyrrolidin-1-yl)benzene-1-sulfonamide
CID 2440433
N-(4-Sulfamoyl-phenyl)-benzamide
CID 721954
1-Methyl-3-Oxo-1,3-Dihydro-Benzo(C)Isothiazole-5-Sulfonic Acid Amide
CID 1387
Isatin Sulfonamide 26
CID 9800285
2,3-dioxo-2,3-dihydro-1H-indole-5-sulfonamide
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5-[[4-(4-Acetylphenyl)-1-piperazinyl]sulfonyl]-1,3-dihydroindol-2-one
CID 20969430
1H-Indole-2,3-dione, 5-(1-azetidinylsulfonyl)-
CID 9903426
N-(2-methoxyethyl)-N-methyl-2,3-dioxo-2,3-dihydro-1H-indole-5-sulfonamide
CID 10851609
N-(4-methylphenyl)-3-(piperidin-1-ylcarbonyl)benzenesulfonamide
CID 2361079
2-(benzenesulfonamido)-N-(thiolan-3-yl)benzamide
CID 2805665
2-(benzylamino)-N-butyl-4-chloro-5-sulfamoylbenzamide
CID 126507891
2-(benzylamino)-4-bromo-N-butyl-5-sulfamoylbenzamide
CID 126508113

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide?
The IUPAC name of 5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide (CID 17453519) is 5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide.
What is the SMILES notation for 5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide?
The canonical SMILES for 5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide is CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)Nc2ccccc2)c1.
What is the InChIKey of 5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide?
The InChIKey is NATUFGGKBOORCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3S/c1-21(2)26(24,25)16-10-11-18(22-12-6-7-13-22)17(14-16)19(23)20-15-8-4-3-5-9-15/h3-5,8-11,14H,6-7,12-13H2,1-2H3,(H,20,23).
What are the key properties of 5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide?
5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide has a molecular weight of 373.48 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylsulfamoyl)-N-phenyl-2-pyrrolidin-1-ylbenzamide is sourced from PubChem (CID 17453519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).