2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide

C19H24N2O4S — CID 132656595

IUPAC2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide
SMILESCCc1ccc(N(C(C)C(=O)Nc2cccc(OC)c2)S(C)(=O)=O)cc1
InChIInChI=1S/C19H24N2O4S/c1-5-15-9-11-17(12-10-15)21(26(4,23)24)14(2)19(22)20-16-7-6-8-18(13-16)25-3/h6-14H,5H2,1-4H3,(H,20,22)
InChIKeyJSSYCDXSPDWCSG-UHFFFAOYSA-N
MW376.48 g/mol
LogP3.05
Rot. Bonds7

About 2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide

2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide (PubChem CID 132656595) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide.

Molecular Properties

Compound Name2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide
PubChem CID132656595
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide
SMILESCCc1ccc(N(C(C)C(=O)Nc2cccc(OC)c2)S(C)(=O)=O)cc1
InChIInChI=1S/C19H24N2O4S/c1-5-15-9-11-17(12-10-15)21(26(4,23)24)14(2)19(22)20-16-7-6-8-18(13-16)25-3/h6-14H,5H2,1-4H3,(H,20,22)
InChIKeyJSSYCDXSPDWCSG-UHFFFAOYSA-N
XLogP3.05
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-(4-ethylphenyl)-2-(4-methoxy-N-methylsulfonylanilino)propanamide
CID 1315154
(2R)-N-(4-ethylphenyl)-2-(4-methoxy-N-methylsulfonylanilino)propanamide
CID 1315152
(2S)-N-(3-bromophenyl)-2-(4-methoxy-N-methylsulfonylanilino)propanamide
CID 1100075
2-(4-ethyl-N-methylsulfonylanilino)-N-(4-propan-2-yloxyphenyl)propanamide
CID 132662307
(2R)-2-(4-methoxy-N-methylsulfonylanilino)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 1095260
(2R)-2-(4-ethoxy-N-methylsulfonylanilino)-N-[3-(methoxymethyl)phenyl]propanamide
CID 125058110
(2R)-2-(4-chloro-N-methylsulfonylanilino)-N-(4-ethylphenyl)propanamide
CID 1265335
2-(4-ethyl-N-methylsulfonylanilino)-N-(4-propan-2-ylphenyl)propanamide
CID 132658835
2-(4-chloro-N-methylsulfonylanilino)-N-(4-ethylphenyl)propanamide
CID 2968377
(2R)-N-(4-ethylphenyl)-2-(3-fluoro-N-methylsulfonylanilino)propanamide
CID 99132716
(2S)-N-(4-ethylphenyl)-2-(3-fluoro-N-methylsulfonylanilino)propanamide
CID 99132717
(2R)-N-(4-butylphenyl)-2-(4-methoxy-N-methylsulfonylanilino)propanamide
CID 2207210

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide?
The IUPAC name of 2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide (CID 132656595) is 2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide.
What is the SMILES notation for 2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide?
The canonical SMILES for 2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide is CCc1ccc(N(C(C)C(=O)Nc2cccc(OC)c2)S(C)(=O)=O)cc1.
What is the InChIKey of 2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide?
The InChIKey is JSSYCDXSPDWCSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-5-15-9-11-17(12-10-15)21(26(4,23)24)14(2)19(22)20-16-7-6-8-18(13-16)25-3/h6-14H,5H2,1-4H3,(H,20,22).
What are the key properties of 2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide?
2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide has a molecular weight of 376.48 g/mol, XLogP of 3.05, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide is sourced from PubChem (CID 132656595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).