2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide

C15H13Cl2FN2O3S — CID 1322792

IUPAC2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide
SMILESCS(=O)(=O)N(CC(=O)Nc1cccc(F)c1)c1cccc(Cl)c1Cl
InChIInChI=1S/C15H13Cl2FN2O3S/c1-24(22,23)20(13-7-3-6-12(16)15(13)17)9-14(21)19-11-5-2-4-10(18)8-11/h2-8H,9H2,1H3,(H,19,21)
InChIKeyGLHPRUOGSQREEX-UHFFFAOYSA-N
MW391.25 g/mol
LogP3.54
Rot. Bonds5

About 2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide

2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide (PubChem CID 1322792) has the molecular formula C15H13Cl2FN2O3S and a molecular weight of 391.25 g/mol. Its IUPAC name is 2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide
PubChem CID1322792
Molecular FormulaC15H13Cl2FN2O3S
Molecular Weight391.25 g/mol
Exact Mass390.00
IUPAC Name2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide
SMILESCS(=O)(=O)N(CC(=O)Nc1cccc(F)c1)c1cccc(Cl)c1Cl
InChIInChI=1S/C15H13Cl2FN2O3S/c1-24(22,23)20(13-7-3-6-12(16)15(13)17)9-14(21)19-11-5-2-4-10(18)8-11/h2-8H,9H2,1H3,(H,19,21)
InChIKeyGLHPRUOGSQREEX-UHFFFAOYSA-N
XLogP3.54
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.25
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromophenyl)-2-(2,3-dichloro-N-methylsulfonylanilino)acetamide
CID 2290391
methyl 2-[[2-(3-fluoroanilino)-2-oxoethyl]-methylsulfonylamino]benzoate
CID 113155917
2-(3-chloro-2-methyl-N-methylsulfonylanilino)-N-(4-fluorophenyl)acetamide
CID 1338522
2-(3-chloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide
CID 1318710
2-(2-chloro-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide
CID 51343168
N-(3-methylphenyl)-2-(2,4,5-trichloro-N-methylsulfonylanilino)acetamide
CID 2223877
N-(3-acetamidophenyl)-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide
CID 113156816
N-(3-acetylphenyl)-2-(2,4,5-trichloro-N-methylsulfonylanilino)acetamide
CID 1249861
N-(2,3-dichlorophenyl)-2-(2,4,5-trichloro-N-methylsulfonylanilino)acetamide
CID 2233147
N-(4-chlorophenyl)-2-(2,4,5-trichloro-N-methylsulfonylanilino)acetamide
CID 3272456
2-(2,3-dichloro-N-methylsulfonylanilino)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 1321054
N-(3-chlorophenyl)-2-(2,3,4-trifluoro-N-methylsulfonylanilino)acetamide
CID 113157541

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide?
The IUPAC name of 2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide (CID 1322792) is 2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide.
What is the SMILES notation for 2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide?
The canonical SMILES for 2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide is CS(=O)(=O)N(CC(=O)Nc1cccc(F)c1)c1cccc(Cl)c1Cl.
What is the InChIKey of 2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide?
The InChIKey is GLHPRUOGSQREEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2FN2O3S/c1-24(22,23)20(13-7-3-6-12(16)15(13)17)9-14(21)19-11-5-2-4-10(18)8-11/h2-8H,9H2,1H3,(H,19,21).
What are the key properties of 2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide?
2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide has a molecular weight of 391.25 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide is sourced from PubChem (CID 1322792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).