2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide

C19H24N2O4S — CID 2271078

IUPAC2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide
SMILESCCOc1ccccc1N(CC(=O)NCCc1ccccc1)S(C)(=O)=O
InChIInChI=1S/C19H24N2O4S/c1-3-25-18-12-8-7-11-17(18)21(26(2,23)24)15-19(22)20-14-13-16-9-5-4-6-10-16/h4-12H,3,13-15H2,1-2H3,(H,20,22)
InChIKeyBIRHOTMMKSBNCV-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.21
Rot. Bonds9

About 2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide

2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide (PubChem CID 2271078) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound Name2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide
PubChem CID2271078
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide
SMILESCCOc1ccccc1N(CC(=O)NCCc1ccccc1)S(C)(=O)=O
InChIInChI=1S/C19H24N2O4S/c1-3-25-18-12-8-7-11-17(18)21(26(2,23)24)15-19(22)20-14-13-16-9-5-4-6-10-16/h4-12H,3,13-15H2,1-2H3,(H,20,22)
InChIKeyBIRHOTMMKSBNCV-UHFFFAOYSA-N
XLogP2.21
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(2-chlorophenyl)propyl]-2-(2-ethoxy-N-methylsulfonylanilino)acetamide
CID 30220284
2-[benzyl-[2-(2-ethoxy-N-methylsulfonylanilino)acetyl]amino]-N-ethylbutanamide
CID 132944069
2-[N-(benzenesulfonyl)-2-ethoxyanilino]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
CID 2894039
N-butan-2-yl-2-(2-ethoxy-N-methylsulfonylanilino)acetamide
CID 3139134
2-(4-ethyl-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide
CID 113154154
2-(N-methylsulfonyl-4-propoxyanilino)-N-(2-phenylethyl)acetamide
CID 30257371
2-(2-ethoxy-N-methylsulfonylanilino)-N-[(2R)-pentan-2-yl]acetamide
CID 7318338
2-(2-ethoxy-N-methylsulfonylanilino)-N-[(2S)-3-methylbutan-2-yl]acetamide
CID 100563293
2-[[2-(2-ethoxy-N-methylsulfonylanilino)acetyl]-(2-phenylethyl)amino]-N-ethylpropanamide
CID 132944007
2-(2-ethoxy-N-methylsulfonylanilino)-N,N-dimethylacetamide
CID 30168858
N-cyclopentyl-2-(2-ethoxy-N-methylsulfonylanilino)acetamide
CID 846470
2-(4-chloro-2-methyl-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide
CID 3700532

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide?
The IUPAC name of 2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide (CID 2271078) is 2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide.
What is the SMILES notation for 2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide?
The canonical SMILES for 2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide is CCOc1ccccc1N(CC(=O)NCCc1ccccc1)S(C)(=O)=O.
What is the InChIKey of 2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide?
The InChIKey is BIRHOTMMKSBNCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-3-25-18-12-8-7-11-17(18)21(26(2,23)24)15-19(22)20-14-13-16-9-5-4-6-10-16/h4-12H,3,13-15H2,1-2H3,(H,20,22).
What are the key properties of 2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide?
2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide has a molecular weight of 376.48 g/mol, XLogP of 2.21, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxy-N-methylsulfonylanilino)-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 2271078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).