N-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide

C9H7N3O2S — CID 90149330

IUPACN-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1cc[nH]c(=O)c1)c1cscn1
InChIInChI=1S/C9H7N3O2S/c13-8-3-6(1-2-10-8)12-9(14)7-4-15-5-11-7/h1-5H,(H2,10,12,13,14)
InChIKeyGVJRWRCROYVECJ-UHFFFAOYSA-N
MW221.24 g/mol
LogP1.08
Rot. Bonds2

About N-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide

N-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide (PubChem CID 90149330) has the molecular formula C9H7N3O2S and a molecular weight of 221.24 g/mol. Its IUPAC name is N-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide
PubChem CID90149330
Molecular FormulaC9H7N3O2S
Molecular Weight221.24 g/mol
Exact Mass221.03
IUPAC NameN-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1cc[nH]c(=O)c1)c1cscn1
InChIInChI=1S/C9H7N3O2S/c13-8-3-6(1-2-10-8)12-9(14)7-4-15-5-11-7/h1-5H,(H2,10,12,13,14)
InChIKeyGVJRWRCROYVECJ-UHFFFAOYSA-N
XLogP1.08
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.24
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide (CID 90149330) is N-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide is O=C(Nc1cc[nH]c(=O)c1)c1cscn1.
What is the InChIKey of N-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide?
The InChIKey is GVJRWRCROYVECJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N3O2S/c13-8-3-6(1-2-10-8)12-9(14)7-4-15-5-11-7/h1-5H,(H2,10,12,13,14).
What are the key properties of N-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide?
N-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide has a molecular weight of 221.24 g/mol, XLogP of 1.08, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-1H-pyridin-4-yl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 90149330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).