N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide

C18H21N3O5S — CID 17192669

IUPACN-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide
SMILESCOc1ccc(S(=O)(=O)NCCC(=O)Nc2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C18H21N3O5S/c1-13(22)20-14-3-5-15(6-4-14)21-18(23)11-12-19-27(24,25)17-9-7-16(26-2)8-10-17/h3-10,19H,11-12H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyLYYVKNSGJVAFOR-UHFFFAOYSA-N
MW391.45 g/mol
LogP1.96
Rot. Bonds8

About N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide

N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide (PubChem CID 17192669) has the molecular formula C18H21N3O5S and a molecular weight of 391.45 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide
PubChem CID17192669
Molecular FormulaC18H21N3O5S
Molecular Weight391.45 g/mol
Exact Mass391.12
IUPAC NameN-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide
SMILESCOc1ccc(S(=O)(=O)NCCC(=O)Nc2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C18H21N3O5S/c1-13(22)20-14-3-5-15(6-4-14)21-18(23)11-12-19-27(24,25)17-9-7-16(26-2)8-10-17/h3-10,19H,11-12H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyLYYVKNSGJVAFOR-UHFFFAOYSA-N
XLogP1.96
TPSA113.60 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.45
LogP ≤ 51.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]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-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
CID 17192102
3-[(4-methoxyphenyl)sulfonylamino]-N-pyridin-4-ylpropanamide
CID 17192611
3-[(3,4-dimethylphenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
CID 9412008
3-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylpropanamide
CID 27793241
4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide
CID 9411896
3-[(4-methoxyphenyl)sulfonylamino]-N-(4-methyl-3-sulfamoylphenyl)propanamide
CID 24637727
3-[(4-methoxyphenyl)sulfonylamino]-N-methylpropanamide
CID 17192561
N-[4-[4-(4-methoxyphenyl)butylsulfamoyl]phenyl]acetamide
CID 110288838
N-[4-[benzyl(methyl)sulfamoyl]phenyl]-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 17192752
N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 17192589
N-(4-acetamidophenyl)-3-(4-methoxyanilino)propanamide
CID 109039685
N-[4-(butylsulfamoyl)phenyl]-3-(4-methoxyphenyl)propanamide
CID 17310703

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide?
The IUPAC name of N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide (CID 17192669) is N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide.
What is the SMILES notation for N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide?
The canonical SMILES for N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide is COc1ccc(S(=O)(=O)NCCC(=O)Nc2ccc(NC(C)=O)cc2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide?
The InChIKey is LYYVKNSGJVAFOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O5S/c1-13(22)20-14-3-5-15(6-4-14)21-18(23)11-12-19-27(24,25)17-9-7-16(26-2)8-10-17/h3-10,19H,11-12H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide?
N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide has a molecular weight of 391.45 g/mol, XLogP of 1.96, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide is sourced from PubChem (CID 17192669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).