2-(4-ethoxy-N-ethylsulfonylanilino)acetamide

C12H18N2O4S — CID 50893065

IUPAC2-(4-ethoxy-N-ethylsulfonylanilino)acetamide
SMILESCCOc1ccc(N(CC(N)=O)S(=O)(=O)CC)cc1
InChIInChI=1S/C12H18N2O4S/c1-3-18-11-7-5-10(6-8-11)14(9-12(13)15)19(16,17)4-2/h5-8H,3-4,9H2,1-2H3,(H2,13,15)
InChIKeyDOLIGFPQJUPSTA-UHFFFAOYSA-N
MW286.35 g/mol
LogP0.73
Rot. Bonds7

About 2-(4-ethoxy-N-ethylsulfonylanilino)acetamide

2-(4-ethoxy-N-ethylsulfonylanilino)acetamide (PubChem CID 50893065) has the molecular formula C12H18N2O4S and a molecular weight of 286.35 g/mol. Its IUPAC name is 2-(4-ethoxy-N-ethylsulfonylanilino)acetamide.

Molecular Properties

Compound Name2-(4-ethoxy-N-ethylsulfonylanilino)acetamide
PubChem CID50893065
Molecular FormulaC12H18N2O4S
Molecular Weight286.35 g/mol
Exact Mass286.10
IUPAC Name2-(4-ethoxy-N-ethylsulfonylanilino)acetamide
SMILESCCOc1ccc(N(CC(N)=O)S(=O)(=O)CC)cc1
InChIInChI=1S/C12H18N2O4S/c1-3-18-11-7-5-10(6-8-11)14(9-12(13)15)19(16,17)4-2/h5-8H,3-4,9H2,1-2H3,(H2,13,15)
InChIKeyDOLIGFPQJUPSTA-UHFFFAOYSA-N
XLogP0.73
TPSA89.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(N-(4-bromophenyl)sulfonyl-4-ethoxyanilino)acetamide
CID 50893049
2-(N-(4-ethoxyphenyl)sulfonylanilino)acetamide
CID 798122
N-(4-ethoxyphenyl)ethanesulfonohydrazide
CID 21126675
2-(4-ethoxy-N-(3-nitrophenyl)sulfonylanilino)acetamide
CID 50893011
2-(N-(4-acetamidophenyl)sulfonyl-4-propoxyanilino)acetamide
CID 50889711
N-(2-amino-2-oxoethyl)-3-(4-ethoxyphenyl)-N-methylpropanamide
CID 56819418
methyl 2-(N-(3,4-dimethoxyphenyl)sulfonyl-4-ethoxyanilino)acetate
CID 1311116
(4-ethoxyphenyl)sulfonylformamide
CID 117038031
2-(4-butoxyphenoxy)acetamide
CID 22974475
N-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-N-(4-ethoxyphenyl)methanesulfonamide
CID 113155268
3-(4-ethoxyphenyl)propanamide;hydrochloride
CID 172679140
ethyl 2-(N-(4-acetamidophenyl)sulfonyl-4-propoxyanilino)acetate
CID 50889690

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxy-N-ethylsulfonylanilino)acetamide?
The IUPAC name of 2-(4-ethoxy-N-ethylsulfonylanilino)acetamide (CID 50893065) is 2-(4-ethoxy-N-ethylsulfonylanilino)acetamide.
What is the SMILES notation for 2-(4-ethoxy-N-ethylsulfonylanilino)acetamide?
The canonical SMILES for 2-(4-ethoxy-N-ethylsulfonylanilino)acetamide is CCOc1ccc(N(CC(N)=O)S(=O)(=O)CC)cc1.
What is the InChIKey of 2-(4-ethoxy-N-ethylsulfonylanilino)acetamide?
The InChIKey is DOLIGFPQJUPSTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O4S/c1-3-18-11-7-5-10(6-8-11)14(9-12(13)15)19(16,17)4-2/h5-8H,3-4,9H2,1-2H3,(H2,13,15).
What are the key properties of 2-(4-ethoxy-N-ethylsulfonylanilino)acetamide?
2-(4-ethoxy-N-ethylsulfonylanilino)acetamide has a molecular weight of 286.35 g/mol, XLogP of 0.73, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxy-N-ethylsulfonylanilino)acetamide is sourced from PubChem (CID 50893065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).