2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide

C17H20N2O4S — CID 745831

IUPAC2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide
SMILESCCOc1ccc(N(CC(=O)Nc2ccccc2)S(C)(=O)=O)cc1
InChIInChI=1S/C17H20N2O4S/c1-3-23-16-11-9-15(10-12-16)19(24(2,21)22)13-17(20)18-14-7-5-4-6-8-14/h4-12H,3,13H2,1-2H3,(H,18,20)
InChIKeyWALWYXVYMMYAFY-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.49
Rot. Bonds7

About 2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide

2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide (PubChem CID 745831) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is 2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide.

Molecular Properties

Compound Name2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide
PubChem CID745831
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC Name2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide
SMILESCCOc1ccc(N(CC(=O)Nc2ccccc2)S(C)(=O)=O)cc1
InChIInChI=1S/C17H20N2O4S/c1-3-23-16-11-9-15(10-12-16)19(24(2,21)22)13-17(20)18-14-7-5-4-6-8-14/h4-12H,3,13H2,1-2H3,(H,18,20)
InChIKeyWALWYXVYMMYAFY-UHFFFAOYSA-N
XLogP2.49
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Diamfenetide
CID 37384
N-(4-Phenoxyphenyl)acetamide
CID 80579
N-[4-(benzyloxy)phenyl]glycinamide
CID 22690393
(4-Methoxyphenyl)-[2-(p-anisidino)ethyl]amine
CID 1809552
Propetamide
CID 68937
Acetamide, N-(4-(3-(4-(2-methoxyphenyl)-1-piperazinyl)propoxy)phenyl)-
CID 55421
Acetamide, N-(4-butoxyphenyl)-
CID 90165
Ucm 765
CID 24749950
(S)-N-hydroxy-2-(phenylamino)-3-(N-(4-(p-tolyloxy)phenyl)methan-2-ylsulfonamido)propanamide
CID 24806175
(S)-N-hydroxy-2-(isopropylamino)-3-(N-(4-(p-tolyloxy)phenyl)methan-2-ylsulfonamido)propanamide
CID 24956229
2-[(2,6-Dimethyl-phenyl)-methanesulfonyl-amino]-N-(4-methoxy-phenyl)-acetamide
CID 1108138
N1-(4-{2-[4-(acetylamino)phenoxy]ethoxy}phenyl)acetamide
CID 1809594

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide?
The IUPAC name of 2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide (CID 745831) is 2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide.
What is the SMILES notation for 2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide?
The canonical SMILES for 2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide is CCOc1ccc(N(CC(=O)Nc2ccccc2)S(C)(=O)=O)cc1.
What is the InChIKey of 2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide?
The InChIKey is WALWYXVYMMYAFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-3-23-16-11-9-15(10-12-16)19(24(2,21)22)13-17(20)18-14-7-5-4-6-8-14/h4-12H,3,13H2,1-2H3,(H,18,20).
What are the key properties of 2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide?
2-(4-ethoxy-N-methylsulfonylanilino)-N-phenylacetamide has a molecular weight of 348.42 g/mol, XLogP of 2.49, 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-methylsulfonylanilino)-N-phenylacetamide is sourced from PubChem (CID 745831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).