1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide

C19H24N2O4S — CID 38867319

IUPAC1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide
SMILESCCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)c2ccc(C)cc2C)c1
InChIInChI=1S/C19H24N2O4S/c1-5-21(6-2)26(24,25)16-8-10-19(23)20(12-16)13-18(22)17-9-7-14(3)11-15(17)4/h7-12H,5-6,13H2,1-4H3
InChIKeyOUACEQHKKOXDOA-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.38
Rot. Bonds7

About 1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide

1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide (PubChem CID 38867319) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide.

Molecular Properties

Compound Name1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide
PubChem CID38867319
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide
SMILESCCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)c2ccc(C)cc2C)c1
InChIInChI=1S/C19H24N2O4S/c1-5-21(6-2)26(24,25)16-8-10-19(23)20(12-16)13-18(22)17-9-7-14(3)11-15(17)4/h7-12H,5-6,13H2,1-4H3
InChIKeyOUACEQHKKOXDOA-UHFFFAOYSA-N
XLogP2.38
TPSA76.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide 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

1-[2-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide
CID 7599929
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N,N-dipropylacetamide
CID 55400476
N-(4-bromo-2-methylphenyl)-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide
CID 16546169
N,N-diethyl-6-oxo-1-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]phenyl]ethyl]pyridine-3-sulfonamide
CID 122508188
3-[2-(2,4-dimethylphenyl)-2-oxoethyl]pyrimidin-4-one
CID 63769538
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-prop-2-enylacetamide
CID 9399528
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(4-methyl-3-nitrophenyl)acetamide
CID 26719575
phenacyl 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetate
CID 7977627
N-butyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-phenylacetamide
CID 43008462
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4,5-trichlorophenyl)acetamide
CID 41114327
1-[(3-acetyl-2,4,6-trimethylphenyl)methyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide
CID 35498413
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4,4-trimethylpentan-2-yl)acetamide
CID 51215892

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide?
The IUPAC name of 1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide (CID 38867319) is 1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide.
What is the SMILES notation for 1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide?
The canonical SMILES for 1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide is CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)c2ccc(C)cc2C)c1.
What is the InChIKey of 1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide?
The InChIKey is OUACEQHKKOXDOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-5-21(6-2)26(24,25)16-8-10-19(23)20(12-16)13-18(22)17-9-7-14(3)11-15(17)4/h7-12H,5-6,13H2,1-4H3.
What are the key properties of 1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide?
1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide has a molecular weight of 376.48 g/mol, XLogP of 2.38, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide is sourced from PubChem (CID 38867319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).