N-benzyl-3-(propylsulfamoyl)benzamide

C17H20N2O3S — CID 9393602

IUPACN-benzyl-3-(propylsulfamoyl)benzamide
SMILESCCCNS(=O)(=O)c1cccc(C(=O)NCc2ccccc2)c1
InChIInChI=1S/C17H20N2O3S/c1-2-11-19-23(21,22)16-10-6-9-15(12-16)17(20)18-13-14-7-4-3-5-8-14/h3-10,12,19H,2,11,13H2,1H3,(H,18,20)
InChIKeySGNPWEWBASVHQI-UHFFFAOYSA-N
MW332.43 g/mol
LogP2.30
Rot. Bonds7

About N-benzyl-3-(propylsulfamoyl)benzamide

N-benzyl-3-(propylsulfamoyl)benzamide (PubChem CID 9393602) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is N-benzyl-3-(propylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-benzyl-3-(propylsulfamoyl)benzamide
PubChem CID9393602
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC NameN-benzyl-3-(propylsulfamoyl)benzamide
SMILESCCCNS(=O)(=O)c1cccc(C(=O)NCc2ccccc2)c1
InChIInChI=1S/C17H20N2O3S/c1-2-11-19-23(21,22)16-10-6-9-15(12-16)17(20)18-13-14-7-4-3-5-8-14/h3-10,12,19H,2,11,13H2,1H3,(H,18,20)
InChIKeySGNPWEWBASVHQI-UHFFFAOYSA-N
XLogP2.30
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-3-[3-(dimethylamino)propylsulfamoyl]benzamide
CID 109064162
3-N-benzyl-1-N-propylbenzene-1,3-dicarboxamide
CID 109050299
3-(propylsulfamoyl)benzoic acid
CID 2442822
3-(benzylsulfamoyl)-N-[(3-bromophenyl)methyl]benzamide
CID 55577848
3-(ethylsulfamoyl)-N-[(3-phenoxyphenyl)methyl]benzamide
CID 39576293
N-[2-(4-chlorophenyl)ethyl]-3-(propylsulfamoyl)benzamide
CID 109061886
N-(3-aminobutyl)-3-(benzylsulfamoyl)benzamide;hydrochloride
CID 119497312
N-[(4-chlorophenyl)methyl]-3-(2-methoxyethylsulfamoyl)benzamide
CID 55565294
3-(3-methylbutylsulfamoyl)-N-[(4-methylphenyl)methyl]benzamide
CID 109064621
N-benzyl-3-(hydrazinecarbonyl)benzenesulfonamide
CID 2442245
3-[2-(dimethylamino)ethylsulfamoyl]-N-(pyridin-4-ylmethyl)benzamide
CID 109063983
N-[2-[[3-(benzylsulfamoyl)benzoyl]amino]ethyl]-2-chlorobenzamide
CID 55659262

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-(propylsulfamoyl)benzamide?
The IUPAC name of N-benzyl-3-(propylsulfamoyl)benzamide (CID 9393602) is N-benzyl-3-(propylsulfamoyl)benzamide.
What is the SMILES notation for N-benzyl-3-(propylsulfamoyl)benzamide?
The canonical SMILES for N-benzyl-3-(propylsulfamoyl)benzamide is CCCNS(=O)(=O)c1cccc(C(=O)NCc2ccccc2)c1.
What is the InChIKey of N-benzyl-3-(propylsulfamoyl)benzamide?
The InChIKey is SGNPWEWBASVHQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-2-11-19-23(21,22)16-10-6-9-15(12-16)17(20)18-13-14-7-4-3-5-8-14/h3-10,12,19H,2,11,13H2,1H3,(H,18,20).
What are the key properties of N-benzyl-3-(propylsulfamoyl)benzamide?
N-benzyl-3-(propylsulfamoyl)benzamide has a molecular weight of 332.43 g/mol, XLogP of 2.30, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-(propylsulfamoyl)benzamide is sourced from PubChem (CID 9393602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).