2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide

C19H23N3O4S — CID 113155828

IUPAC2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1NC(=O)CN(c1ccc(NC(C)=O)cc1)S(C)(=O)=O
InChIInChI=1S/C19H23N3O4S/c1-4-15-7-5-6-8-18(15)21-19(24)13-22(27(3,25)26)17-11-9-16(10-12-17)20-14(2)23/h5-12H,4,13H2,1-3H3,(H,20,23)(H,21,24)
InChIKeyWAJFTSKMIMRIHJ-UHFFFAOYSA-N
MW389.48 g/mol
LogP2.61
Rot. Bonds7

About 2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide

2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide (PubChem CID 113155828) has the molecular formula C19H23N3O4S and a molecular weight of 389.48 g/mol. Its IUPAC name is 2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide
PubChem CID113155828
Molecular FormulaC19H23N3O4S
Molecular Weight389.48 g/mol
Exact Mass389.14
IUPAC Name2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1NC(=O)CN(c1ccc(NC(C)=O)cc1)S(C)(=O)=O
InChIInChI=1S/C19H23N3O4S/c1-4-15-7-5-6-8-18(15)21-19(24)13-22(27(3,25)26)17-11-9-16(10-12-17)20-14(2)23/h5-12H,4,13H2,1-3H3,(H,20,23)(H,21,24)
InChIKeyWAJFTSKMIMRIHJ-UHFFFAOYSA-N
XLogP2.61
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.48
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethylphenyl)-2-(N-methylsulfonylanilino)acetamide
CID 846890
2-[4-(dimethylsulfamoyl)-N-methylsulfonylanilino]-N-(2-ethylphenyl)acetamide
CID 30258733
2-(3,4-dichloro-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide
CID 1321675
2-(3,4-difluoro-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide
CID 53280656
2-(4-acetamido-N-methylsulfonylanilino)-N-(4-methylphenyl)acetamide
CID 113155819
2-(3-chloro-4-methyl-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide
CID 998783
N-(4-acetamidophenyl)-2-(4-iodo-N-methylsulfonylanilino)acetamide
CID 2942786
N-(4-acetamidophenyl)-2-(N-methylsulfonyl-4-phenoxyanilino)acetamide
CID 1319046
2-(4-ethyl-N-methylsulfonylanilino)-N-phenylacetamide
CID 951908
N-(2,6-diethylphenyl)-2-(N-methylsulfonylanilino)acetamide
CID 113153665
N-[4-(dimethylamino)phenyl]-2-(4-ethyl-N-methylsulfonylanilino)acetamide
CID 113154194
2-(3-cyano-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide
CID 51333753

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide?
The IUPAC name of 2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide (CID 113155828) is 2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide.
What is the SMILES notation for 2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide?
The canonical SMILES for 2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide is CCc1ccccc1NC(=O)CN(c1ccc(NC(C)=O)cc1)S(C)(=O)=O.
What is the InChIKey of 2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide?
The InChIKey is WAJFTSKMIMRIHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4S/c1-4-15-7-5-6-8-18(15)21-19(24)13-22(27(3,25)26)17-11-9-16(10-12-17)20-14(2)23/h5-12H,4,13H2,1-3H3,(H,20,23)(H,21,24).
What are the key properties of 2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide?
2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide has a molecular weight of 389.48 g/mol, XLogP of 2.61, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamido-N-methylsulfonylanilino)-N-(2-ethylphenyl)acetamide is sourced from PubChem (CID 113155828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).