N-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide

C10H9N3O2S — CID 820193

IUPACN-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1csc(NC(=O)c2ccc[nH]c2=O)n1
InChIInChI=1S/C10H9N3O2S/c1-6-5-16-10(12-6)13-9(15)7-3-2-4-11-8(7)14/h2-5H,1H3,(H,11,14)(H,12,13,15)
InChIKeyYOHLKVNOKZZMGG-UHFFFAOYSA-N
MW235.27 g/mol
LogP1.39
Rot. Bonds2

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

N-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 820193) has the molecular formula C10H9N3O2S and a molecular weight of 235.27 g/mol. Its IUPAC name is N-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID820193
Molecular FormulaC10H9N3O2S
Molecular Weight235.27 g/mol
Exact Mass235.04
IUPAC NameN-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1csc(NC(=O)c2ccc[nH]c2=O)n1
InChIInChI=1S/C10H9N3O2S/c1-6-5-16-10(12-6)13-9(15)7-3-2-4-11-8(7)14/h2-5H,1H3,(H,11,14)(H,12,13,15)
InChIKeyYOHLKVNOKZZMGG-UHFFFAOYSA-N
XLogP1.39
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.27
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide (CID 820193) is N-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide is Cc1csc(NC(=O)c2ccc[nH]c2=O)n1.
What is the InChIKey of N-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is YOHLKVNOKZZMGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2S/c1-6-5-16-10(12-6)13-9(15)7-3-2-4-11-8(7)14/h2-5H,1H3,(H,11,14)(H,12,13,15).
What are the key properties of N-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide?
N-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 235.27 g/mol, XLogP of 1.39, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 820193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).