2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide

C23H24N2O3S — CID 4052421

IUPAC2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide
SMILESCCc1ccccc1N(CC(=O)Nc1ccccc1C)S(=O)(=O)c1ccccc1
InChIInChI=1S/C23H24N2O3S/c1-3-19-12-8-10-16-22(19)25(29(27,28)20-13-5-4-6-14-20)17-23(26)24-21-15-9-7-11-18(21)2/h4-16H,3,17H2,1-2H3,(H,24,26)
InChIKeyHMWARVXBHDLVRS-UHFFFAOYSA-N
MW408.52 g/mol
LogP4.39
Rot. Bonds7

About 2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide

2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide (PubChem CID 4052421) has the molecular formula C23H24N2O3S and a molecular weight of 408.52 g/mol. Its IUPAC name is 2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide
PubChem CID4052421
Molecular FormulaC23H24N2O3S
Molecular Weight408.52 g/mol
Exact Mass408.15
IUPAC Name2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide
SMILESCCc1ccccc1N(CC(=O)Nc1ccccc1C)S(=O)(=O)c1ccccc1
InChIInChI=1S/C23H24N2O3S/c1-3-19-12-8-10-16-22(19)25(29(27,28)20-13-5-4-6-14-20)17-23(26)24-21-15-9-7-11-18(21)2/h4-16H,3,17H2,1-2H3,(H,24,26)
InChIKeyHMWARVXBHDLVRS-UHFFFAOYSA-N
XLogP4.39
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.52
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-[N-(benzenesulfonyl)-2-ethylanilino]acetyl]amino]benzoic acid
CID 51343247
2-[N-(benzenesulfonyl)-2,3-dimethylanilino]-N-(2-methylphenyl)acetamide
CID 1334553
2-[N-(benzenesulfonyl)-2-methylanilino]-N-(2,6-diethylphenyl)acetamide
CID 26565897
2-[N-(benzenesulfonyl)-2-fluoroanilino]-N-(2-ethylphenyl)acetamide
CID 1095217
2-[N-(benzenesulfonyl)-2-chloroanilino]-N-(2-ethylphenyl)acetamide
CID 1098076
2-[N-(benzenesulfonyl)-2,3-dimethylanilino]-N-(2,3-dimethylphenyl)acetamide
CID 1311343
N-(5-chloro-2-methylphenyl)-2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)acetamide
CID 1335769
2-[[2-[N-(benzenesulfonyl)-2-ethylanilino]acetyl]amino]-N-[(2S)-butan-2-yl]benzamide
CID 1296650
2-[N-(benzenesulfonyl)-2-methylanilino]-N-(2-propan-2-ylphenyl)acetamide
CID 2111548
2-[N-(benzenesulfonyl)-3,4-dimethylanilino]-N-(2-ethylphenyl)acetamide
CID 30169297
2-[N-(benzenesulfonyl)-2-methylanilino]-N-(2,3-dichlorophenyl)acetamide
CID 21372817
2-[N-(benzenesulfonyl)-2-ethylanilino]-N-[(S)-(2-methylphenyl)-phenylmethyl]acetamide
CID 30303921

Frequently Asked Questions

What is the IUPAC name of 2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide (CID 4052421) is 2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide is CCc1ccccc1N(CC(=O)Nc1ccccc1C)S(=O)(=O)c1ccccc1.
What is the InChIKey of 2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide?
The InChIKey is HMWARVXBHDLVRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3S/c1-3-19-12-8-10-16-22(19)25(29(27,28)20-13-5-4-6-14-20)17-23(26)24-21-15-9-7-11-18(21)2/h4-16H,3,17H2,1-2H3,(H,24,26).
What are the key properties of 2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide?
2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide has a molecular weight of 408.52 g/mol, XLogP of 4.39, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[N-(benzenesulfonyl)-2-ethylanilino]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 4052421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).