1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one

C9H8N2OS — CID 176887841

IUPAC1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one
SMILESCc1cnc(-n2ccccc2=O)s1
InChIInChI=1S/C9H8N2OS/c1-7-6-10-9(13-7)11-5-3-2-4-8(11)12/h2-6H,1H3
InChIKeyQBZWCIAFHBESGE-UHFFFAOYSA-N
MW192.24 g/mol
LogP1.60
Rot. Bonds1

About 1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one

1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one (PubChem CID 176887841) has the molecular formula C9H8N2OS and a molecular weight of 192.24 g/mol. Its IUPAC name is 1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one.

Molecular Properties

Compound Name1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one
PubChem CID176887841
Molecular FormulaC9H8N2OS
Molecular Weight192.24 g/mol
Exact Mass192.04
IUPAC Name1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one
SMILESCc1cnc(-n2ccccc2=O)s1
InChIInChI=1S/C9H8N2OS/c1-7-6-10-9(13-7)11-5-3-2-4-8(11)12/h2-6H,1H3
InChIKeyQBZWCIAFHBESGE-UHFFFAOYSA-N
XLogP1.60
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one?
The IUPAC name of 1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one (CID 176887841) is 1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one.
What is the SMILES notation for 1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one?
The canonical SMILES for 1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one is Cc1cnc(-n2ccccc2=O)s1.
What is the InChIKey of 1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one?
The InChIKey is QBZWCIAFHBESGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS/c1-7-6-10-9(13-7)11-5-3-2-4-8(11)12/h2-6H,1H3.
What are the key properties of 1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one?
1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one has a molecular weight of 192.24 g/mol, XLogP of 1.60, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one is sourced from PubChem (CID 176887841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).