5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide

C14H18N2O3S2 — CID 11631241

IUPAC5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide
SMILESCCc1cc(-c2ccc(S(=O)(=O)N(C)C)s2)c(C)[nH]c1=O
InChIInChI=1S/C14H18N2O3S2/c1-5-10-8-11(9(2)15-14(10)17)12-6-7-13(20-12)21(18,19)16(3)4/h6-8H,5H2,1-4H3,(H,15,17)
InChIKeyFMKLZHRLTHTVFP-UHFFFAOYSA-N
MW326.44 g/mol
LogP2.22
Rot. Bonds4

About 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide

5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide (PubChem CID 11631241) has the molecular formula C14H18N2O3S2 and a molecular weight of 326.44 g/mol. Its IUPAC name is 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide.

Molecular Properties

Compound Name5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide
PubChem CID11631241
Molecular FormulaC14H18N2O3S2
Molecular Weight326.44 g/mol
Exact Mass326.08
IUPAC Name5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide
SMILESCCc1cc(-c2ccc(S(=O)(=O)N(C)C)s2)c(C)[nH]c1=O
InChIInChI=1S/C14H18N2O3S2/c1-5-10-8-11(9(2)15-14(10)17)12-6-7-13(20-12)21(18,19)16(3)4/h6-8H,5H2,1-4H3,(H,15,17)
InChIKeyFMKLZHRLTHTVFP-UHFFFAOYSA-N
XLogP2.22
TPSA70.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide 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 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide?
The IUPAC name of 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide (CID 11631241) is 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide.
What is the SMILES notation for 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide?
The canonical SMILES for 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide is CCc1cc(-c2ccc(S(=O)(=O)N(C)C)s2)c(C)[nH]c1=O.
What is the InChIKey of 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide?
The InChIKey is FMKLZHRLTHTVFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3S2/c1-5-10-8-11(9(2)15-14(10)17)12-6-7-13(20-12)21(18,19)16(3)4/h6-8H,5H2,1-4H3,(H,15,17).
What are the key properties of 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide?
5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide has a molecular weight of 326.44 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N,N-dimethylthiophene-2-sulfonamide is sourced from PubChem (CID 11631241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).