2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide

C16H17ClN2O3S — CID 112996149

IUPAC2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CNS(=O)(=O)c2ccc(Cl)c(C)c2)c1
InChIInChI=1S/C16H17ClN2O3S/c1-11-4-3-5-13(8-11)19-16(20)10-18-23(21,22)14-6-7-15(17)12(2)9-14/h3-9,18H,10H2,1-2H3,(H,19,20)
InChIKeyJJAWHCABXTZHSQ-UHFFFAOYSA-N
MW352.84 g/mol
LogP2.87
Rot. Bonds5

About 2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide

2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide (PubChem CID 112996149) has the molecular formula C16H17ClN2O3S and a molecular weight of 352.84 g/mol. Its IUPAC name is 2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide
PubChem CID112996149
Molecular FormulaC16H17ClN2O3S
Molecular Weight352.84 g/mol
Exact Mass352.06
IUPAC Name2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CNS(=O)(=O)c2ccc(Cl)c(C)c2)c1
InChIInChI=1S/C16H17ClN2O3S/c1-11-4-3-5-13(8-11)19-16(20)10-18-23(21,22)14-6-7-15(17)12(2)9-14/h3-9,18H,10H2,1-2H3,(H,19,20)
InChIKeyJJAWHCABXTZHSQ-UHFFFAOYSA-N
XLogP2.87
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.84
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-2-[(4-chloro-3-methylphenyl)sulfonylamino]acetamide
CID 112999779
N-(4-tert-butylphenyl)-2-[(4-chloro-3-methylphenyl)sulfonylamino]acetamide
CID 112997620
2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-methylphenyl)acetamide
CID 1055767
N-(3-chloro-4-methylphenyl)-2-[(3,4-dimethylphenyl)sulfonylamino]acetamide
CID 112998194
N-(3,4-dimethylphenyl)-2-[(3-methylphenyl)sulfonylamino]acetamide
CID 112996585
N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide
CID 772299
N-(3-cyanophenyl)-2-[(3,4-dichlorophenyl)sulfonylamino]acetamide
CID 113001969
2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(3-methylphenyl)acetamide
CID 23603181
N-(3-chlorophenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]acetamide
CID 9042351
2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998662
2-[(3-chloro-4-fluorophenyl)sulfonylamino]-N-(3-fluorophenyl)acetamide
CID 52813347
methyl 3-[[2-[(3,4-dimethylphenyl)sulfonylamino]acetyl]amino]benzoate
CID 112999907

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide (CID 112996149) is 2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide is Cc1cccc(NC(=O)CNS(=O)(=O)c2ccc(Cl)c(C)c2)c1.
What is the InChIKey of 2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide?
The InChIKey is JJAWHCABXTZHSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O3S/c1-11-4-3-5-13(8-11)19-16(20)10-18-23(21,22)14-6-7-15(17)12(2)9-14/h3-9,18H,10H2,1-2H3,(H,19,20).
What are the key properties of 2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide?
2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide has a molecular weight of 352.84 g/mol, XLogP of 2.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 112996149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).