4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide

C17H20N2O3S — CID 2486190

IUPAC4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide
SMILESCc1cc(C)c(C)c(S(=O)(=O)Nc2ccc(C(N)=O)cc2)c1C
InChIInChI=1S/C17H20N2O3S/c1-10-9-11(2)13(4)16(12(10)3)23(21,22)19-15-7-5-14(6-8-15)17(18)20/h5-9,19H,1-4H3,(H2,18,20)
InChIKeyWNSXTRPLMDKPAC-UHFFFAOYSA-N
MW332.43 g/mol
LogP2.82
Rot. Bonds4

About 4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide

4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide (PubChem CID 2486190) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is 4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound Name4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide
PubChem CID2486190
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC Name4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide
SMILESCc1cc(C)c(C)c(S(=O)(=O)Nc2ccc(C(N)=O)cc2)c1C
InChIInChI=1S/C17H20N2O3S/c1-10-9-11(2)13(4)16(12(10)3)23(21,22)19-15-7-5-14(6-8-15)17(18)20/h5-9,19H,1-4H3,(H2,18,20)
InChIKeyWNSXTRPLMDKPAC-UHFFFAOYSA-N
XLogP2.82
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]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

N-Sulfanilyl-3,4-xylamide
CID 67118
4'-(4-Aminobenzoyl)biphenyl-4-Sulfonamide
CID 91995964
N-(4-Acetylphenyl)-4-tert-butylbenzenesulfonamide
CID 583674
N-(4-acetylphenyl)-2,4,6-trimethylbenzenesulfonamide
CID 795024
4-[(4-tert-butylphenyl)sulfonylamino]-N-hydroxybenzamide
CID 86231496
N-(4-acetylphenyl)-4-isobutylbenzenesulfonamide
CID 768834
4-(2,4,6-Trimethylbenzenesulfonamido)benzamide
CID 788808
2-Methyl-5-{[(2-methylphenyl)amino]sulfonyl}benzamide
CID 797060
N-(4-acetylphenyl)-3-methylbenzenesulfonamide
CID 889998
4-Methyl-3-{[(4-methylphenyl)amino]sulfonyl}benzamide
CID 967339
3-[(2,5-Dimethylphenyl)sulfamoyl]-4-methylbenzamide
CID 967593
2,3,5,6-tetramethyl-N-(4-(pyrrolidine-1-carbonyl)phenyl)benzenesulfonamide
CID 984583

Frequently Asked Questions

What is the IUPAC name of 4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide?
The IUPAC name of 4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide (CID 2486190) is 4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for 4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide?
The canonical SMILES for 4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide is Cc1cc(C)c(C)c(S(=O)(=O)Nc2ccc(C(N)=O)cc2)c1C.
What is the InChIKey of 4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide?
The InChIKey is WNSXTRPLMDKPAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-10-9-11(2)13(4)16(12(10)3)23(21,22)19-15-7-5-14(6-8-15)17(18)20/h5-9,19H,1-4H3,(H2,18,20).
What are the key properties of 4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide?
4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide has a molecular weight of 332.43 g/mol, XLogP of 2.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 2486190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).