3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide

C16H17N3O4S — CID 31580637

IUPAC3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide
SMILESCNC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c1
InChIInChI=1S/C16H17N3O4S/c1-11(20)18-13-6-8-15(9-7-13)24(22,23)19-14-5-3-4-12(10-14)16(21)17-2/h3-10,19H,1-2H3,(H,17,21)(H,18,20)
InChIKeyPHNOTVWZYNCKCV-UHFFFAOYSA-N
MW347.40 g/mol
LogP1.81
Rot. Bonds5

About 3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide

3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide (PubChem CID 31580637) has the molecular formula C16H17N3O4S and a molecular weight of 347.40 g/mol. Its IUPAC name is 3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide.

Molecular Properties

Compound Name3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide
PubChem CID31580637
Molecular FormulaC16H17N3O4S
Molecular Weight347.40 g/mol
Exact Mass347.09
IUPAC Name3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide
SMILESCNC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c1
InChIInChI=1S/C16H17N3O4S/c1-11(20)18-13-6-8-15(9-7-13)24(22,23)19-14-5-3-4-12(10-14)16(21)17-2/h3-10,19H,1-2H3,(H,17,21)(H,18,20)
InChIKeyPHNOTVWZYNCKCV-UHFFFAOYSA-N
XLogP1.81
TPSA104.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.40
LogP ≤ 51.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide 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

3-[(4-tert-butylphenyl)sulfonylamino]-N-methylbenzamide
CID 31580711
3-[(3,4-dichlorophenyl)sulfonylamino]-N-[4-(methylcarbamoyl)phenyl]benzamide
CID 24635607
3-acetamido-N-[4-[(4-iodophenyl)sulfamoyl]phenyl]benzamide
CID 2114640
3-[(4-acetamidophenyl)sulfonylamino]-N-benzylbenzamide
CID 17377321
N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 7542008
3-[(3-bromophenyl)sulfonylamino]-N-methylbenzamide
CID 31580763
3-[(4-bromo-3-methylphenyl)sulfonylamino]-N-methylbenzamide
CID 31580790
N-(4-bromophenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 1287289
N-methyl-3-[(3-methylphenyl)sulfamoyl]benzamide
CID 51163012
3-[2-[3-[(4-acetamidophenyl)sulfonylamino]phenyl]ethyl]benzoic acid
CID 68688702
3-[(4-methoxyphenyl)sulfonylamino]-N-[4-[4-[[3-[(4-methoxyphenyl)sulfonylamino]benzoyl]amino]phenyl]phenyl]benzamide
CID 121043305
N-[3-[(4-acetamidophenyl)sulfonylamino]phenyl]-2,2-dimethylpropanamide
CID 1026291

Frequently Asked Questions

What is the IUPAC name of 3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide?
The IUPAC name of 3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide (CID 31580637) is 3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide.
What is the SMILES notation for 3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide?
The canonical SMILES for 3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide is CNC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c1.
What is the InChIKey of 3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide?
The InChIKey is PHNOTVWZYNCKCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O4S/c1-11(20)18-13-6-8-15(9-7-13)24(22,23)19-14-5-3-4-12(10-14)16(21)17-2/h3-10,19H,1-2H3,(H,17,21)(H,18,20).
What are the key properties of 3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide?
3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide has a molecular weight of 347.40 g/mol, XLogP of 1.81, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide is sourced from PubChem (CID 31580637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).