N-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide

C17H18ClN3O4S — CID 1319508

IUPACN-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)cc1
InChIInChI=1S/C17H18ClN3O4S/c1-12(22)19-13-7-9-14(10-8-13)20-17(23)11-21(26(2,24)25)16-6-4-3-5-15(16)18/h3-10H,11H2,1-2H3,(H,19,22)(H,20,23)
InChIKeyPDFYPGMNZMDYPH-UHFFFAOYSA-N
MW395.87 g/mol
LogP2.70
Rot. Bonds6

About N-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide

N-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide (PubChem CID 1319508) has the molecular formula C17H18ClN3O4S and a molecular weight of 395.87 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide
PubChem CID1319508
Molecular FormulaC17H18ClN3O4S
Molecular Weight395.87 g/mol
Exact Mass395.07
IUPAC NameN-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)cc1
InChIInChI=1S/C17H18ClN3O4S/c1-12(22)19-13-7-9-14(10-8-13)20-17(23)11-21(26(2,24)25)16-6-4-3-5-15(16)18/h3-10H,11H2,1-2H3,(H,19,22)(H,20,23)
InChIKeyPDFYPGMNZMDYPH-UHFFFAOYSA-N
XLogP2.70
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.87
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide 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

Clodacaine
CID 58616
2-(2-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide
CID 1364364
2-[N-(2-chlorophenyl)methanesulfonamido]-N-phenylacetamide
CID 4384110
N~2~-(2-chlorophenyl)-N-(2,5-dichlorophenyl)-N~2~-(methylsulfonyl)glycinamide
CID 4876025
2-[[2-(2-chloroanilino)-2-oxoethyl]-methylamino]-N-phenylacetamide
CID 2115027
N-(2-chlorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide
CID 600179
N~2~-(3-chloro-4-fluorophenyl)-N~2~-(methylsulfonyl)glycinamide
CID 967375
N-{2-[4-(3-Chloro-phenyl)-piperazin-1-yl]-2-oxo-ethyl}-N-cyclohexyl-methanesulfonamide
CID 1021986
N~2~-cyclohexyl-N~1~-(3,4-dichlorophenyl)-N~2~-(methylsulfonyl)glycinamide
CID 1293322
N~1~-[4-(acetylamino)phenyl]-N~2~-(2,5-dichlorophenyl)-N~2~-(methylsulfonyl)glycinamide
CID 1314405
2-[Benzenesulfonyl-(4-chloro-phenyl)-amino]-N-ethyl-acetamide
CID 2271056
N-(4-acetamidophenyl)-2-[[2-(3-chloroanilino)-2-oxoethyl]-ethylamino]acetamide
CID 2538951

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide (CID 1319508) is N-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide is CC(=O)Nc1ccc(NC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide?
The InChIKey is PDFYPGMNZMDYPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClN3O4S/c1-12(22)19-13-7-9-14(10-8-13)20-17(23)11-21(26(2,24)25)16-6-4-3-5-15(16)18/h3-10H,11H2,1-2H3,(H,19,22)(H,20,23).
What are the key properties of N-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide?
N-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide has a molecular weight of 395.87 g/mol, XLogP of 2.70, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(2-chloro-N-methylsulfonylanilino)acetamide is sourced from PubChem (CID 1319508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).