2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide

C23H24N2O4S — CID 42585731

IUPAC2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide
SMILESCc1ccc(NC(=O)Cn2c(C)cc(C)c(S(=O)(=O)c3ccccc3)c2=O)c(C)c1
InChIInChI=1S/C23H24N2O4S/c1-15-10-11-20(16(2)12-15)24-21(26)14-25-18(4)13-17(3)22(23(25)27)30(28,29)19-8-6-5-7-9-19/h5-13H,14H2,1-4H3,(H,24,26)
InChIKeyGZPABAMRNFYKDM-UHFFFAOYSA-N
MW424.52 g/mol
LogP3.55
Rot. Bonds5

About 2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide

2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide (PubChem CID 42585731) has the molecular formula C23H24N2O4S and a molecular weight of 424.52 g/mol. Its IUPAC name is 2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide
PubChem CID42585731
Molecular FormulaC23H24N2O4S
Molecular Weight424.52 g/mol
Exact Mass424.15
IUPAC Name2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide
SMILESCc1ccc(NC(=O)Cn2c(C)cc(C)c(S(=O)(=O)c3ccccc3)c2=O)c(C)c1
InChIInChI=1S/C23H24N2O4S/c1-15-10-11-20(16(2)12-15)24-21(26)14-25-18(4)13-17(3)22(23(25)27)30(28,29)19-8-6-5-7-9-19/h5-13H,14H2,1-4H3,(H,24,26)
InChIKeyGZPABAMRNFYKDM-UHFFFAOYSA-N
XLogP3.55
TPSA85.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.52
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide?
The IUPAC name of 2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide (CID 42585731) is 2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide.
What is the SMILES notation for 2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide?
The canonical SMILES for 2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide is Cc1ccc(NC(=O)Cn2c(C)cc(C)c(S(=O)(=O)c3ccccc3)c2=O)c(C)c1.
What is the InChIKey of 2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide?
The InChIKey is GZPABAMRNFYKDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4S/c1-15-10-11-20(16(2)12-15)24-21(26)14-25-18(4)13-17(3)22(23(25)27)30(28,29)19-8-6-5-7-9-19/h5-13H,14H2,1-4H3,(H,24,26).
What are the key properties of 2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide?
2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide has a molecular weight of 424.52 g/mol, XLogP of 3.55, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(benzenesulfonyl)-4,6-dimethyl-2-oxo-1-pyridinyl]-N-(2,4-dimethylphenyl)acetamide is sourced from PubChem (CID 42585731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).