3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide

C13H20N2O3S — CID 110342905

IUPAC3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide
SMILESCCCNC(=O)CCS(=O)(=O)N(C)c1ccccc1
InChIInChI=1S/C13H20N2O3S/c1-3-10-14-13(16)9-11-19(17,18)15(2)12-7-5-4-6-8-12/h4-8H,3,9-11H2,1-2H3,(H,14,16)
InChIKeyNPOLCRMFHDTSSH-UHFFFAOYSA-N
MW284.38 g/mol
LogP1.37
Rot. Bonds7

About 3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide

3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide (PubChem CID 110342905) has the molecular formula C13H20N2O3S and a molecular weight of 284.38 g/mol. Its IUPAC name is 3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide.

Molecular Properties

Compound Name3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide
PubChem CID110342905
Molecular FormulaC13H20N2O3S
Molecular Weight284.38 g/mol
Exact Mass284.12
IUPAC Name3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide
SMILESCCCNC(=O)CCS(=O)(=O)N(C)c1ccccc1
InChIInChI=1S/C13H20N2O3S/c1-3-10-14-13(16)9-11-19(17,18)15(2)12-7-5-4-6-8-12/h4-8H,3,9-11H2,1-2H3,(H,14,16)
InChIKeyNPOLCRMFHDTSSH-UHFFFAOYSA-N
XLogP1.37
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3,4-dimethylphenyl)-N-[2-[methyl(phenyl)sulfamoyl]ethyl]butanamide
CID 110626723
2-(4-chlorophenyl)-N-[2-[methyl(phenyl)sulfamoyl]ethyl]acetamide
CID 110287682
N-[2-[methyl(phenyl)sulfamoyl]ethyl]-4-oxo-4-pyridin-3-ylbutanamide
CID 110626756
N-(4-ethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]propanamide
CID 110342993
N-hydroxy-8-[methyl(phenyl)sulfamoyl]octanamide
CID 10131480
ethyl 2-[2-[methyl(phenyl)sulfamoyl]ethylamino]-2-oxoacetate
CID 110287709
N-benzyl-N-methyl-3-[methyl(phenyl)sulfamoyl]propanamide
CID 110342924
N-benzyl-N-ethyl-3-[methyl(phenyl)sulfamoyl]propanamide
CID 110342932
4-[methyl(phenyl)sulfamoyl]-N-propylbenzamide
CID 2432115
4-tert-butyl-N-[2-[methyl(phenyl)sulfamoyl]ethyl]benzamide
CID 110287677
2-[methyl(phenyl)sulfamoyl]acetic acid
CID 28773465
3-[methyl-[2-oxo-2-(propylamino)ethyl]sulfamoyl]propanoic acid
CID 60952620

Frequently Asked Questions

What is the IUPAC name of 3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide?
The IUPAC name of 3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide (CID 110342905) is 3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide.
What is the SMILES notation for 3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide?
The canonical SMILES for 3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide is CCCNC(=O)CCS(=O)(=O)N(C)c1ccccc1.
What is the InChIKey of 3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide?
The InChIKey is NPOLCRMFHDTSSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3S/c1-3-10-14-13(16)9-11-19(17,18)15(2)12-7-5-4-6-8-12/h4-8H,3,9-11H2,1-2H3,(H,14,16).
What are the key properties of 3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide?
3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide has a molecular weight of 284.38 g/mol, XLogP of 1.37, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methyl(phenyl)sulfamoyl]-N-propylpropanamide is sourced from PubChem (CID 110342905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).