3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide

C15H24N2O3S — CID 30482009

IUPAC3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)CCNS(=O)(=O)c1cc(C)ccc1C
InChIInChI=1S/C15H24N2O3S/c1-5-17(6-2)15(18)9-10-16-21(19,20)14-11-12(3)7-8-13(14)4/h7-8,11,16H,5-6,9-10H2,1-4H3
InChIKeyWZEZGBWMWZIDBK-UHFFFAOYSA-N
MW312.44 g/mol
LogP1.84
Rot. Bonds7

About 3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide

3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide (PubChem CID 30482009) has the molecular formula C15H24N2O3S and a molecular weight of 312.44 g/mol. Its IUPAC name is 3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide.

Molecular Properties

Compound Name3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide
PubChem CID30482009
Molecular FormulaC15H24N2O3S
Molecular Weight312.44 g/mol
Exact Mass312.15
IUPAC Name3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)CCNS(=O)(=O)c1cc(C)ccc1C
InChIInChI=1S/C15H24N2O3S/c1-5-17(6-2)15(18)9-10-16-21(19,20)14-11-12(3)7-8-13(14)4/h7-8,11,16H,5-6,9-10H2,1-4H3
InChIKeyWZEZGBWMWZIDBK-UHFFFAOYSA-N
XLogP1.84
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.44
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide 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

N-(cyclopropylmethyl)-3-[(2,5-dimethylphenyl)sulfonylamino]-N-propylpropanamide
CID 78785842
N-butyl-2,5-dimethylbenzenesulfonamide
CID 2414109
N-(2-anilino-2-oxoethyl)-3-[(2,5-dimethylphenyl)sulfonylamino]-N-methylpropanamide
CID 46822994
3-[[3-(diethylamino)-3-oxopropyl]sulfamoyl]thiophene-2-carboxylic acid
CID 60925499
3-[(2,4-dimethylphenyl)sulfonylamino]-N-methoxy-N-methylpropanamide
CID 47159796
3-[(2,5-dimethylphenyl)sulfonylamino]-N-[(4-methylphenyl)methyl]propanamide
CID 24637071
N-[(2,4-dimethylphenyl)methyl]-3-[(2,5-dimethylphenyl)sulfonylamino]propanamide
CID 46587654
3-[(2-amino-6-methylphenyl)sulfonylamino]-N,N-diethylpropanamide
CID 61125157
3-[ethyl-[3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoyl]amino]propanoic acid
CID 120516640
3-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-ethoxyphenyl)propanamide
CID 78768790
2-[(2,5-dimethylphenyl)sulfonylamino]acetamide
CID 9189431
N-decyl-2,5-dimethylbenzenesulfonamide
CID 19681411

Frequently Asked Questions

What is the IUPAC name of 3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide?
The IUPAC name of 3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide (CID 30482009) is 3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide.
What is the SMILES notation for 3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide?
The canonical SMILES for 3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide is CCN(CC)C(=O)CCNS(=O)(=O)c1cc(C)ccc1C.
What is the InChIKey of 3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide?
The InChIKey is WZEZGBWMWZIDBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3S/c1-5-17(6-2)15(18)9-10-16-21(19,20)14-11-12(3)7-8-13(14)4/h7-8,11,16H,5-6,9-10H2,1-4H3.
What are the key properties of 3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide?
3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide has a molecular weight of 312.44 g/mol, XLogP of 1.84, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,5-dimethylphenyl)sulfonylamino]-N,N-diethylpropanamide is sourced from PubChem (CID 30482009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).