N-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide

C15H12Cl2F2N2O3S — CID 9173126

IUPACN-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide
SMILESCS(=O)(=O)N(CC(=O)Nc1cc(Cl)cc(Cl)c1)c1ccc(F)c(F)c1
InChIInChI=1S/C15H12Cl2F2N2O3S/c1-25(23,24)21(12-2-3-13(18)14(19)7-12)8-15(22)20-11-5-9(16)4-10(17)6-11/h2-7H,8H2,1H3,(H,20,22)
InChIKeyZJPYFWSEQMJHKW-UHFFFAOYSA-N
MW409.24 g/mol
LogP3.68
Rot. Bonds5

About N-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide

N-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide (PubChem CID 9173126) has the molecular formula C15H12Cl2F2N2O3S and a molecular weight of 409.24 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide
PubChem CID9173126
Molecular FormulaC15H12Cl2F2N2O3S
Molecular Weight409.24 g/mol
Exact Mass407.99
IUPAC NameN-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide
SMILESCS(=O)(=O)N(CC(=O)Nc1cc(Cl)cc(Cl)c1)c1ccc(F)c(F)c1
InChIInChI=1S/C15H12Cl2F2N2O3S/c1-25(23,24)21(12-2-3-13(18)14(19)7-12)8-15(22)20-11-5-9(16)4-10(17)6-11/h2-7H,8H2,1H3,(H,20,22)
InChIKeyZJPYFWSEQMJHKW-UHFFFAOYSA-N
XLogP3.68
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.24
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3,4-difluoro-N-methylsulfonylanilino)-N-(4-fluorophenyl)acetamide
CID 53280757
N-(3-acetylphenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide
CID 113157714
2-(3-chloro-4-fluoro-N-methylsulfonylanilino)-N-phenylacetamide
CID 1260653
ethyl 2-chloro-5-[[2-(3,4-difluoro-N-methylsulfonylanilino)acetyl]amino]benzoate
CID 46764450
N-(3-chloro-4-fluorophenyl)-2-(3,4-dichloro-N-methylsulfonylanilino)acetamide
CID 1290563
2-(3,4-difluoro-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide
CID 53280656
2-(3-acetamido-N-methylsulfonylanilino)-N-(3,4-difluorophenyl)acetamide
CID 113155767
2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide
CID 1082246
2-(3,4-dichloro-N-methylsulfonylanilino)-N-(4-fluorophenyl)acetamide
CID 1315632
2-(2-chloro-N-methylsulfonylanilino)-N-(3,5-dichlorophenyl)acetamide
CID 51343181
N-(3,5-dichlorophenyl)-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
CID 30261658
N-(3,5-dichlorophenyl)-2-[methyl(methylsulfonyl)amino]acetamide
CID 30464486

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide?
The IUPAC name of N-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide (CID 9173126) is N-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide is CS(=O)(=O)N(CC(=O)Nc1cc(Cl)cc(Cl)c1)c1ccc(F)c(F)c1.
What is the InChIKey of N-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide?
The InChIKey is ZJPYFWSEQMJHKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2F2N2O3S/c1-25(23,24)21(12-2-3-13(18)14(19)7-12)8-15(22)20-11-5-9(16)4-10(17)6-11/h2-7H,8H2,1H3,(H,20,22).
What are the key properties of N-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide?
N-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide has a molecular weight of 409.24 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-2-(3,4-difluoro-N-methylsulfonylanilino)acetamide is sourced from PubChem (CID 9173126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).