3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide

C19H23NO5S — CID 110418653

IUPAC3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide
SMILESCCc1ccccc1NC(=O)CCS(=O)(=O)c1ccc(OC)c(OC)c1
InChIInChI=1S/C19H23NO5S/c1-4-14-7-5-6-8-16(14)20-19(21)11-12-26(22,23)15-9-10-17(24-2)18(13-15)25-3/h5-10,13H,4,11-12H2,1-3H3,(H,20,21)
InChIKeyACHLNLCZFJDKNP-UHFFFAOYSA-N
MW377.46 g/mol
LogP3.07
Rot. Bonds8

About 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide

3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide (PubChem CID 110418653) has the molecular formula C19H23NO5S and a molecular weight of 377.46 g/mol. Its IUPAC name is 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide.

Molecular Properties

Compound Name3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide
PubChem CID110418653
Molecular FormulaC19H23NO5S
Molecular Weight377.46 g/mol
Exact Mass377.13
IUPAC Name3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide
SMILESCCc1ccccc1NC(=O)CCS(=O)(=O)c1ccc(OC)c(OC)c1
InChIInChI=1S/C19H23NO5S/c1-4-14-7-5-6-8-16(14)20-19(21)11-12-26(22,23)15-9-10-17(24-2)18(13-15)25-3/h5-10,13H,4,11-12H2,1-3H3,(H,20,21)
InChIKeyACHLNLCZFJDKNP-UHFFFAOYSA-N
XLogP3.07
TPSA81.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.46
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(3-chloro-4-methoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide
CID 110418654
3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide
CID 110422136
3-(3,4-dimethoxyphenyl)sulfonyl-N-(2,4-dimethylphenyl)propanamide
CID 110417830
2-(3,4-dimethoxyphenyl)-N-(2-ethylphenyl)acetamide
CID 2674953
N-tert-butyl-3-(3,4-dimethoxyphenyl)sulfonylpropanamide
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3-(3-chloro-4-methoxyphenyl)sulfonyl-N-(2-cyanophenyl)propanamide
CID 110428380
2-[2-(3,4-dimethoxyphenyl)sulfonyl-3,5-dimethylanilino]-N-(2-ethylphenyl)acetamide
CID 22304013
N-(3,4-dimethoxyphenyl)-N'-(2-ethylphenyl)oxamide
CID 44999448
3-(2-bromo-4,5-dimethoxyphenyl)-N-(2-ethylphenyl)propanamide
CID 1406221
3-(3,4-dimethoxyphenyl)sulfonyl-N,N-diethylpropanamide
CID 110414798
2-[(3-chloro-4-methoxyphenyl)sulfonylamino]-N-(2-ethylphenyl)acetamide
CID 37497691
N-(2-ethylphenyl)-3-[(3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]propanamide
CID 126458893

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide?
The IUPAC name of 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide (CID 110418653) is 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide.
What is the SMILES notation for 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide?
The canonical SMILES for 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide is CCc1ccccc1NC(=O)CCS(=O)(=O)c1ccc(OC)c(OC)c1.
What is the InChIKey of 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide?
The InChIKey is ACHLNLCZFJDKNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO5S/c1-4-14-7-5-6-8-16(14)20-19(21)11-12-26(22,23)15-9-10-17(24-2)18(13-15)25-3/h5-10,13H,4,11-12H2,1-3H3,(H,20,21).
What are the key properties of 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide?
3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide has a molecular weight of 377.46 g/mol, XLogP of 3.07, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide is sourced from PubChem (CID 110418653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).