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

C19H23NO6S — CID 110422136

IUPAC3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide
SMILESCCOc1ccccc1NC(=O)CCS(=O)(=O)c1ccc(OC)c(OC)c1
InChIInChI=1S/C19H23NO6S/c1-4-26-16-8-6-5-7-15(16)20-19(21)11-12-27(22,23)14-9-10-17(24-2)18(13-14)25-3/h5-10,13H,4,11-12H2,1-3H3,(H,20,21)
InChIKeyQTQPROYCHNVQKG-UHFFFAOYSA-N
MW393.46 g/mol
LogP2.90
Rot. Bonds9

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

3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide (PubChem CID 110422136) has the molecular formula C19H23NO6S and a molecular weight of 393.46 g/mol. Its IUPAC name is 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide.

Molecular Properties

Compound Name3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide
PubChem CID110422136
Molecular FormulaC19H23NO6S
Molecular Weight393.46 g/mol
Exact Mass393.12
IUPAC Name3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide
SMILESCCOc1ccccc1NC(=O)CCS(=O)(=O)c1ccc(OC)c(OC)c1
InChIInChI=1S/C19H23NO6S/c1-4-26-16-8-6-5-7-15(16)20-19(21)11-12-27(22,23)14-9-10-17(24-2)18(13-14)25-3/h5-10,13H,4,11-12H2,1-3H3,(H,20,21)
InChIKeyQTQPROYCHNVQKG-UHFFFAOYSA-N
XLogP2.90
TPSA90.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.46
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide
CID 110418653
3-(3,4-dimethoxyphenyl)sulfonyl-N-(2,4-dimethylphenyl)propanamide
CID 110417830
3-(3-chloro-4-methoxyphenyl)sulfonyl-N-(2-ethylphenyl)propanamide
CID 110418654
3-[(1-acetyl-2,3-dihydroindol-5-yl)sulfonyl]-N-(2-ethoxyphenyl)propanamide
CID 15993621
2-(N-(3,4-dimethoxyphenyl)sulfonyl-2,5-dimethoxyanilino)-N-(2-ethoxyphenyl)acetamide
CID 2942722
N-(2-ethoxyphenyl)-3-[(2-ethyl-3-oxo-4H-1,4-benzothiazin-7-yl)sulfonyl]propanamide
CID 126459538
N-(2-ethoxyphenyl)-2-(2-methoxyphenoxy)acetamide
CID 3891399
3-(4-chlorophenyl)sulfonyl-N-(2-propoxyphenyl)propanamide
CID 26898062
N-(2,5-diethoxyphenyl)-3-(4-methylphenyl)sulfonylpropanamide
CID 4101955
N-tert-butyl-3-(3,4-dimethoxyphenyl)sulfonylpropanamide
CID 110415267
3-(3,4-dimethoxyphenyl)sulfonyl-N,N-diethylpropanamide
CID 110414798
N-(2-ethoxyphenyl)-3-(2-methoxy-5-methylanilino)propanamide
CID 47882363

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide?
The IUPAC name of 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide (CID 110422136) is 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide.
What is the SMILES notation for 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide?
The canonical SMILES for 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide is CCOc1ccccc1NC(=O)CCS(=O)(=O)c1ccc(OC)c(OC)c1.
What is the InChIKey of 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide?
The InChIKey is QTQPROYCHNVQKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO6S/c1-4-26-16-8-6-5-7-15(16)20-19(21)11-12-27(22,23)14-9-10-17(24-2)18(13-14)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-ethoxyphenyl)propanamide?
3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide has a molecular weight of 393.46 g/mol, XLogP of 2.90, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethoxyphenyl)sulfonyl-N-(2-ethoxyphenyl)propanamide is sourced from PubChem (CID 110422136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).