N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide

C9H8N4O2S — CID 115661254

IUPACN-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCc1nsc(NC(=O)c2ccc(=O)[nH]c2)n1
InChIInChI=1S/C9H8N4O2S/c1-5-11-9(16-13-5)12-8(15)6-2-3-7(14)10-4-6/h2-4H,1H3,(H,10,14)(H,11,12,13,15)
InChIKeyADAOHTVFLGWHOW-UHFFFAOYSA-N
MW236.26 g/mol
LogP0.79
Rot. Bonds2

About N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide

N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 115661254) has the molecular formula C9H8N4O2S and a molecular weight of 236.26 g/mol. Its IUPAC name is N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID115661254
Molecular FormulaC9H8N4O2S
Molecular Weight236.26 g/mol
Exact Mass236.04
IUPAC NameN-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCc1nsc(NC(=O)c2ccc(=O)[nH]c2)n1
InChIInChI=1S/C9H8N4O2S/c1-5-11-9(16-13-5)12-8(15)6-2-3-7(14)10-4-6/h2-4H,1H3,(H,10,14)(H,11,12,13,15)
InChIKeyADAOHTVFLGWHOW-UHFFFAOYSA-N
XLogP0.79
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.26
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide 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

5-[(3-methyl-1,2,4-thiadiazol-5-yl)carbamoyl]pyridine-2-carboxylic acid
CID 113246377
4-(aminomethyl)-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamide
CID 104694500
6-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)-4-oxo-1H-pyridine-3-carboxamide
CID 103718323
6-oxo-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide
CID 8005265
2-fluoro-N-(3-methyl-1,2,4-thiadiazol-5-yl)pyridine-4-carboxamide
CID 115661242
N-[4-[2-(ethylamino)-2-oxoethyl]-1,3-thiazol-2-yl]-6-oxo-1H-pyridine-3-carboxamide
CID 16881607
N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-6-oxo-1H-pyridine-3-carboxamide
CID 4826765
3-hydroxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-4-nitrobenzamide
CID 103712002
3-fluoro-N-(3-methyl-1,2,4-thiadiazol-5-yl)-4-nitrobenzamide
CID 115661259
4-amino-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-nitrobenzamide
CID 115661232
N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide
CID 17013680
3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide
CID 91900874

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide (CID 115661254) is N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide is Cc1nsc(NC(=O)c2ccc(=O)[nH]c2)n1.
What is the InChIKey of N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is ADAOHTVFLGWHOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N4O2S/c1-5-11-9(16-13-5)12-8(15)6-2-3-7(14)10-4-6/h2-4H,1H3,(H,10,14)(H,11,12,13,15).
What are the key properties of N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide?
N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 236.26 g/mol, XLogP of 0.79, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 115661254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).