2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide

C18H20N2O5S — CID 1180425

IUPAC2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide
SMILESCCOc1ccccc1NC(=O)CS(=O)(=O)CC(=O)Nc1ccccc1
InChIInChI=1S/C18H20N2O5S/c1-2-25-16-11-7-6-10-15(16)20-18(22)13-26(23,24)12-17(21)19-14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3,(H,19,21)(H,20,22)
InChIKeyHJRKCVXBHANEKB-UHFFFAOYSA-N
MW376.43 g/mol
LogP2.08
Rot. Bonds8

About 2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide

2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide (PubChem CID 1180425) has the molecular formula C18H20N2O5S and a molecular weight of 376.43 g/mol. Its IUPAC name is 2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide.

Molecular Properties

Compound Name2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide
PubChem CID1180425
Molecular FormulaC18H20N2O5S
Molecular Weight376.43 g/mol
Exact Mass376.11
IUPAC Name2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide
SMILESCCOc1ccccc1NC(=O)CS(=O)(=O)CC(=O)Nc1ccccc1
InChIInChI=1S/C18H20N2O5S/c1-2-25-16-11-7-6-10-15(16)20-18(22)13-26(23,24)12-17(21)19-14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3,(H,19,21)(H,20,22)
InChIKeyHJRKCVXBHANEKB-UHFFFAOYSA-N
XLogP2.08
TPSA101.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.43
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2-cyanophenyl)methylsulfonyl]-N-(2-ethoxyphenyl)acetamide
CID 1412164
N-(4-acetylphenyl)-N'-(2-ethoxyphenyl)propanediamide
CID 108955673
CID 174193763
CID 174193763
2-benzylsulfonyl-N-(2-methoxyphenyl)acetamide
CID 4306504
methyl 3-(2-ethoxyanilino)-3-oxopropanoate
CID 28637956
(2S)-2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfanyl-N-phenylpropanamide
CID 1412115
N-(2-ethoxyphenyl)-3-phenylpropanamide
CID 849126
1-N'-(2-ethoxyphenyl)-1-N-phenylcyclopropane-1,1-dicarboxamide
CID 108980570
N-(2-ethoxyphenyl)-3-methylbutanamide
CID 849236
3-amino-N-(2-ethoxyphenyl)propanamide;hydrochloride
CID 119263917
N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide
CID 108952937
1-(2-ethoxyphenyl)-3-(4-phenylphenyl)urea
CID 108867158

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide?
The IUPAC name of 2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide (CID 1180425) is 2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide.
What is the SMILES notation for 2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide?
The canonical SMILES for 2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide is CCOc1ccccc1NC(=O)CS(=O)(=O)CC(=O)Nc1ccccc1.
What is the InChIKey of 2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide?
The InChIKey is HJRKCVXBHANEKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O5S/c1-2-25-16-11-7-6-10-15(16)20-18(22)13-26(23,24)12-17(21)19-14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3,(H,19,21)(H,20,22).
What are the key properties of 2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide?
2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide has a molecular weight of 376.43 g/mol, XLogP of 2.08, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfonyl-N-phenylacetamide is sourced from PubChem (CID 1180425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).