2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide

C17H18ClN3O4S — CID 112998145

IUPAC2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(Cl)cc2C)cc1
InChIInChI=1S/C17H18ClN3O4S/c1-11-9-13(18)3-8-16(11)21-17(23)10-19-26(24,25)15-6-4-14(5-7-15)20-12(2)22/h3-9,19H,10H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyNYQQAEPOGBCWIR-UHFFFAOYSA-N
MW395.87 g/mol
LogP2.52
Rot. Bonds6

About 2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide

2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide (PubChem CID 112998145) has the molecular formula C17H18ClN3O4S and a molecular weight of 395.87 g/mol. Its IUPAC name is 2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide
PubChem CID112998145
Molecular FormulaC17H18ClN3O4S
Molecular Weight395.87 g/mol
Exact Mass395.07
IUPAC Name2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(Cl)cc2C)cc1
InChIInChI=1S/C17H18ClN3O4S/c1-11-9-13(18)3-8-16(11)21-17(23)10-19-26(24,25)15-6-4-14(5-7-15)20-12(2)22/h3-9,19H,10H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyNYQQAEPOGBCWIR-UHFFFAOYSA-N
XLogP2.52
TPSA104.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.87
LogP ≤ 52.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chloro-2-methylphenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide
CID 112998154
N-(4-acetamidophenyl)-2-[(4-chloro-3-methylphenyl)sulfonylamino]acetamide
CID 112999779
N-(4-acetamidophenyl)-2-[(3-chlorophenyl)sulfonylamino]acetamide
CID 112999785
N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
CID 112998153
N-(4-acetylphenyl)-2-[(4-chlorophenyl)sulfonylamino]acetamide
CID 112999628
[2-(4-chloro-2-methylanilino)-2-oxoethyl] 2-[(4-fluorophenyl)sulfonylamino]acetate
CID 7954053
3-(benzenesulfonamido)-N-(4-chloro-2-methylphenyl)propanamide
CID 26687749
N-(4-acetamidophenyl)-2-[(4-bromophenyl)sulfonylamino]acetamide
CID 1316272
2-(4-chloroanilino)-N-(4-chloro-2-methylphenyl)acetamide
CID 26506560
N-[4-[[4-[(5-chloro-2-methylphenyl)sulfamoyl]phenyl]sulfamoyl]phenyl]acetamide
CID 1319892
N-(2,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide
CID 113001324
2-[(4-acetamidophenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998688

Frequently Asked Questions

What is the IUPAC name of 2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide?
The IUPAC name of 2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide (CID 112998145) is 2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide.
What is the SMILES notation for 2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide?
The canonical SMILES for 2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide is CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(Cl)cc2C)cc1.
What is the InChIKey of 2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide?
The InChIKey is NYQQAEPOGBCWIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClN3O4S/c1-11-9-13(18)3-8-16(11)21-17(23)10-19-26(24,25)15-6-4-14(5-7-15)20-12(2)22/h3-9,19H,10H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of 2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide?
2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide has a molecular weight of 395.87 g/mol, XLogP of 2.52, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-acetamidophenyl)sulfonylamino]-N-(4-chloro-2-methylphenyl)acetamide is sourced from PubChem (CID 112998145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).