2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide

C15H14Cl2N2O3S — CID 1082246

IUPAC2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide
SMILESCS(=O)(=O)N(CC(=O)Nc1cccc(Cl)c1)c1cccc(Cl)c1
InChIInChI=1S/C15H14Cl2N2O3S/c1-23(21,22)19(14-7-3-5-12(17)9-14)10-15(20)18-13-6-2-4-11(16)8-13/h2-9H,10H2,1H3,(H,18,20)
InChIKeyMFSBONGCZBLYHZ-UHFFFAOYSA-N
MW373.26 g/mol
LogP3.40
Rot. Bonds5

About 2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide

2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide (PubChem CID 1082246) has the molecular formula C15H14Cl2N2O3S and a molecular weight of 373.26 g/mol. Its IUPAC name is 2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide
PubChem CID1082246
Molecular FormulaC15H14Cl2N2O3S
Molecular Weight373.26 g/mol
Exact Mass372.01
IUPAC Name2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide
SMILESCS(=O)(=O)N(CC(=O)Nc1cccc(Cl)c1)c1cccc(Cl)c1
InChIInChI=1S/C15H14Cl2N2O3S/c1-23(21,22)19(14-7-3-5-12(17)9-14)10-15(20)18-13-6-2-4-11(16)8-13/h2-9H,10H2,1H3,(H,18,20)
InChIKeyMFSBONGCZBLYHZ-UHFFFAOYSA-N
XLogP3.40
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.26
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-chloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide
CID 1318710
3-[[2-(3-chloro-N-methylsulfonylanilino)acetyl]amino]-N,N-dimethylbenzamide
CID 29331543
N-(3-chlorophenyl)-2-(4-ethyl-N-methylsulfonylanilino)acetamide
CID 113154183
2-(3-chloro-N-methylsulfonylanilino)-N-ethylacetamide
CID 3139153
2-(3-chloro-N-methylsulfonylanilino)-N-[3-(2-thiophen-2-ylethynyl)phenyl]acetamide
CID 35230459
3-(3-chloro-N-methylsulfonylanilino)-N-phenylpropanamide
CID 113143812
N-(3-chlorophenyl)-2-(2,3,4-trifluoro-N-methylsulfonylanilino)acetamide
CID 113157541
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(3-chloro-N-methylsulfonylanilino)acetamide
CID 21372809
2-(3-acetamido-N-methylsulfonylanilino)-N-(3,4-difluorophenyl)acetamide
CID 113155767
2-[tert-butyl(methylsulfonyl)amino]-N-(3-chlorophenyl)acetamide
CID 113152943
N-(3-chlorophenyl)-2-(2-cyano-N-methylsulfonylanilino)acetamide
CID 113157216
N-(4-chloro-2-methylphenyl)-2-(3-methyl-N-methylsulfonylanilino)acetamide
CID 51342537

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide?
The IUPAC name of 2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide (CID 1082246) is 2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide.
What is the SMILES notation for 2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide?
The canonical SMILES for 2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide is CS(=O)(=O)N(CC(=O)Nc1cccc(Cl)c1)c1cccc(Cl)c1.
What is the InChIKey of 2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide?
The InChIKey is MFSBONGCZBLYHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O3S/c1-23(21,22)19(14-7-3-5-12(17)9-14)10-15(20)18-13-6-2-4-11(16)8-13/h2-9H,10H2,1H3,(H,18,20).
What are the key properties of 2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide?
2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide has a molecular weight of 373.26 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide is sourced from PubChem (CID 1082246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).