2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide

C15H13Cl3N2O3S — CID 4876025

IUPAC2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide
SMILESCS(=O)(=O)N(CC(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1Cl
InChIInChI=1S/C15H13Cl3N2O3S/c1-24(22,23)20(14-5-3-2-4-12(14)18)9-15(21)19-13-8-10(16)6-7-11(13)17/h2-8H,9H2,1H3,(H,19,21)
InChIKeyNQFLYAOFEUVUQL-UHFFFAOYSA-N
MW407.71 g/mol
LogP4.05
Rot. Bonds5

About 2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide

2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide (PubChem CID 4876025) has the molecular formula C15H13Cl3N2O3S and a molecular weight of 407.71 g/mol. Its IUPAC name is 2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide
PubChem CID4876025
Molecular FormulaC15H13Cl3N2O3S
Molecular Weight407.71 g/mol
Exact Mass405.97
IUPAC Name2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide
SMILESCS(=O)(=O)N(CC(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1Cl
InChIInChI=1S/C15H13Cl3N2O3S/c1-24(22,23)20(14-5-3-2-4-12(14)18)9-15(21)19-13-8-10(16)6-7-11(13)17/h2-8H,9H2,1H3,(H,19,21)
InChIKeyNQFLYAOFEUVUQL-UHFFFAOYSA-N
XLogP4.05
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.71
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide
CID 1364364
2-[N-(2-chlorophenyl)methanesulfonamido]-N-phenylacetamide
CID 4384110
2-[[2-(2-chloroanilino)-2-oxoethyl]-methylamino]-N-phenylacetamide
CID 2115027
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
N~1~-[4-(acetylamino)phenyl]-N~2~-(2-chlorophenyl)-N~2~-(methylsulfonyl)glycinamide
CID 1319508
2-(2-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)propanamide
CID 71456112
N-(2-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide
CID 2393895
N-(2,5-Dichlorophenyl)-2-(1-piperidinyl)acetamide
CID 703605
N-(2,5-dichlorophenyl)-2-(propylamino)acetamide
CID 4339123

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide?
The IUPAC name of 2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide (CID 4876025) is 2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide?
The canonical SMILES for 2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide is CS(=O)(=O)N(CC(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1Cl.
What is the InChIKey of 2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide?
The InChIKey is NQFLYAOFEUVUQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl3N2O3S/c1-24(22,23)20(14-5-3-2-4-12(14)18)9-15(21)19-13-8-10(16)6-7-11(13)17/h2-8H,9H2,1H3,(H,19,21).
What are the key properties of 2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide?
2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide has a molecular weight of 407.71 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-N-methylsulfonylanilino)-N-(2,5-dichlorophenyl)acetamide is sourced from PubChem (CID 4876025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).