2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide

C22H22N2O4S — CID 1095152

IUPAC2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)CN(c1ccccc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C22H22N2O4S/c1-2-28-21-16-10-9-15-20(21)23-22(25)17-24(18-11-5-3-6-12-18)29(26,27)19-13-7-4-8-14-19/h3-16H,2,17H2,1H3,(H,23,25)
InChIKeyGNRGAECYRNJJQA-UHFFFAOYSA-N
MW410.50 g/mol
LogP3.92
Rot. Bonds8

About 2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide

2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide (PubChem CID 1095152) has the molecular formula C22H22N2O4S and a molecular weight of 410.50 g/mol. Its IUPAC name is 2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide
PubChem CID1095152
Molecular FormulaC22H22N2O4S
Molecular Weight410.50 g/mol
Exact Mass410.13
IUPAC Name2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)CN(c1ccccc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C22H22N2O4S/c1-2-28-21-16-10-9-15-20(21)23-22(25)17-24(18-11-5-3-6-12-18)29(26,27)19-13-7-4-8-14-19/h3-16H,2,17H2,1H3,(H,23,25)
InChIKeyGNRGAECYRNJJQA-UHFFFAOYSA-N
XLogP3.92
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.50
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[N-(benzenesulfonyl)-4-iodoanilino]-N-(2-ethoxyphenyl)acetamide
CID 126123006
N-(2-ethoxyphenyl)-2-(4-methyl-N-(4-methylphenyl)sulfonylanilino)acetamide
CID 1098081
2-[N-(benzenesulfonyl)-3-nitroanilino]-N-(2-ethoxyphenyl)acetamide
CID 1016308
N-(2-ethoxyphenyl)-2-(4-fluoro-N-(4-methylphenyl)sulfonylanilino)acetamide
CID 1095185
N-(2-ethoxyphenyl)-2-(N-(4-methoxy-3-methylphenyl)sulfonylanilino)acetamide
CID 30259956
N-(2-ethoxyphenyl)-2-(4-methyl-N-(4-methylsulfanylphenyl)sulfonylanilino)acetamide
CID 1349588
N-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonyl-4-propan-2-ylanilino)acetamide
CID 1372189
2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethoxyphenyl)acetamide
CID 994355
N-(2-ethoxyphenyl)-2-(4-methoxy-N-(3-methylphenyl)sulfonylanilino)acetamide
CID 2087980
2-[N-(benzenesulfonyl)-5-chloro-2-methylanilino]-N-(2-ethoxyphenyl)acetamide
CID 1099987
N-(2-ethoxyphenyl)-2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonylanilino)acetamide
CID 30259950
2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide
CID 126029637

Frequently Asked Questions

What is the IUPAC name of 2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide?
The IUPAC name of 2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide (CID 1095152) is 2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide?
The canonical SMILES for 2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide is CCOc1ccccc1NC(=O)CN(c1ccccc1)S(=O)(=O)c1ccccc1.
What is the InChIKey of 2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide?
The InChIKey is GNRGAECYRNJJQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O4S/c1-2-28-21-16-10-9-15-20(21)23-22(25)17-24(18-11-5-3-6-12-18)29(26,27)19-13-7-4-8-14-19/h3-16H,2,17H2,1H3,(H,23,25).
What are the key properties of 2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide?
2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide has a molecular weight of 410.50 g/mol, XLogP of 3.92, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide is sourced from PubChem (CID 1095152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).