N-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide

C23H23N3O4S — CID 30231205

IUPACN-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide
SMILESCC(=O)Nc1cccc(NC(=O)CN(c2ccccc2)S(=O)(=O)c2ccc(C)cc2)c1
InChIInChI=1S/C23H23N3O4S/c1-17-11-13-22(14-12-17)31(29,30)26(21-9-4-3-5-10-21)16-23(28)25-20-8-6-7-19(15-20)24-18(2)27/h3-15H,16H2,1-2H3,(H,24,27)(H,25,28)
InChIKeyAOVAMASYJQADOE-UHFFFAOYSA-N
MW437.52 g/mol
LogP3.79
Rot. Bonds7

About N-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide

N-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide (PubChem CID 30231205) has the molecular formula C23H23N3O4S and a molecular weight of 437.52 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide
PubChem CID30231205
Molecular FormulaC23H23N3O4S
Molecular Weight437.52 g/mol
Exact Mass437.14
IUPAC NameN-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide
SMILESCC(=O)Nc1cccc(NC(=O)CN(c2ccccc2)S(=O)(=O)c2ccc(C)cc2)c1
InChIInChI=1S/C23H23N3O4S/c1-17-11-13-22(14-12-17)31(29,30)26(21-9-4-3-5-10-21)16-23(28)25-20-8-6-7-19(15-20)24-18(2)27/h3-15H,16H2,1-2H3,(H,24,27)(H,25,28)
InChIKeyAOVAMASYJQADOE-UHFFFAOYSA-N
XLogP3.79
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.52
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dichlorophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide
CID 126341497
N-(3-cyanophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide
CID 25497895
N-(3-acetamidophenyl)-2-[methyl-(4-methylphenyl)sulfonylamino]acetamide
CID 27055361
2-(4-fluoro-N-(4-methylphenyl)sulfonylanilino)-N-(3-fluorophenyl)acetamide
CID 1320131
2-(3,4-dimethyl-N-(4-methylphenyl)sulfonylanilino)-N-phenylacetamide
CID 51345395
N-[3-[[2-[N-(benzenesulfonyl)-4-methylanilino]acetyl]amino]phenyl]-4-tert-butylbenzamide
CID 43901818
N-(4-acetamidophenyl)-2-[N-(benzenesulfonyl)-3,5-dimethylanilino]acetamide
CID 126137622
N-(4-acetamidophenyl)-2-(N-(4-chlorophenyl)sulfonylanilino)acetamide
CID 126153307
N-(3-acetylphenyl)-2-(N-(3-methylphenyl)sulfonylanilino)acetamide
CID 18097238
N-(3-bromophenyl)-2-(4-chloro-N-(4-methylphenyl)sulfonylanilino)acetamide
CID 30171190
2-(3-methyl-N-(4-methylphenyl)sulfonylanilino)-N-[3-[methyl(methylsulfonyl)amino]phenyl]acetamide
CID 126142617
2-(4-chloro-N-(4-methylphenyl)sulfonylanilino)-N-[3-[methyl(methylsulfonyl)amino]phenyl]acetamide
CID 1315993

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide?
The IUPAC name of N-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide (CID 30231205) is N-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide is CC(=O)Nc1cccc(NC(=O)CN(c2ccccc2)S(=O)(=O)c2ccc(C)cc2)c1.
What is the InChIKey of N-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide?
The InChIKey is AOVAMASYJQADOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O4S/c1-17-11-13-22(14-12-17)31(29,30)26(21-9-4-3-5-10-21)16-23(28)25-20-8-6-7-19(15-20)24-18(2)27/h3-15H,16H2,1-2H3,(H,24,27)(H,25,28).
What are the key properties of N-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide?
N-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide has a molecular weight of 437.52 g/mol, XLogP of 3.79, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide is sourced from PubChem (CID 30231205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).