N-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide

C19H24N2O4S — CID 4136271

IUPACN-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide
SMILESCCS(=O)(=O)N(CC(=O)Nc1ccc(C)c(C)c1)c1ccc(OC)cc1
InChIInChI=1S/C19H24N2O4S/c1-5-26(23,24)21(17-8-10-18(25-4)11-9-17)13-19(22)20-16-7-6-14(2)15(3)12-16/h6-12H,5,13H2,1-4H3,(H,20,22)
InChIKeyQVNLEXIGQXKBFR-UHFFFAOYSA-N
MW376.48 g/mol
LogP3.11
Rot. Bonds7

About N-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide

N-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide (PubChem CID 4136271) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide
PubChem CID4136271
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide
SMILESCCS(=O)(=O)N(CC(=O)Nc1ccc(C)c(C)c1)c1ccc(OC)cc1
InChIInChI=1S/C19H24N2O4S/c1-5-26(23,24)21(17-8-10-18(25-4)11-9-17)13-19(22)20-16-7-6-14(2)15(3)12-16/h6-12H,5,13H2,1-4H3,(H,20,22)
InChIKeyQVNLEXIGQXKBFR-UHFFFAOYSA-N
XLogP3.11
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(N-(4-acetamidophenyl)sulfonyl-4-methoxyanilino)-N-(3,4-dimethylphenyl)acetamide
CID 1204001
N-(3,4-dimethylphenyl)-2-(N-(3,5-dimethylpyrazolidin-4-yl)sulfonyl-4-methoxyanilino)acetamide
CID 78313406
N-(3,4-dimethoxyphenyl)-2-(4-methoxy-N-methylsulfonylanilino)acetamide
CID 998735
2-(N-(3,4-dimethoxyphenyl)sulfonyl-4-ethoxyanilino)-N-(3,4-dimethylphenyl)acetamide
CID 53280565
N-(3,4-dimethylphenyl)-2-(3-methoxy-N-methylsulfonylanilino)acetamide
CID 1098104
N-(3,4-dimethylphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide
CID 53280522
N-(3,4-dimethylphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide
CID 99818118
2-(N-ethylsulfonyl-4-methoxyanilino)-N-(2-methoxyethyl)acetamide
CID 39358683
2-(N-(4-chlorophenyl)sulfonyl-4-ethoxyanilino)-N-(3,4-dimethylphenyl)acetamide
CID 1363400
2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(3,4-dimethylphenyl)acetamide
CID 2890006
2-(N-ethylsulfonyl-4-methoxyanilino)-N-(2-methylpropyl)acetamide
CID 4052422
N-(4-iodophenyl)-2-(4-methoxy-N-(4-methyl-3-nitrophenyl)sulfonylanilino)acetamide
CID 2890634

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide?
The IUPAC name of N-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide (CID 4136271) is N-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide is CCS(=O)(=O)N(CC(=O)Nc1ccc(C)c(C)c1)c1ccc(OC)cc1.
What is the InChIKey of N-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide?
The InChIKey is QVNLEXIGQXKBFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-5-26(23,24)21(17-8-10-18(25-4)11-9-17)13-19(22)20-16-7-6-14(2)15(3)12-16/h6-12H,5,13H2,1-4H3,(H,20,22).
What are the key properties of N-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide?
N-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide has a molecular weight of 376.48 g/mol, XLogP of 3.11, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-2-(N-ethylsulfonyl-4-methoxyanilino)acetamide is sourced from PubChem (CID 4136271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).