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

C9H9N3OS — CID 58710057

IUPAC5-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one
SMILESCn1cc(N)cc(-c2cncs2)c1=O
InChIInChI=1S/C9H9N3OS/c1-12-4-6(10)2-7(9(12)13)8-3-11-5-14-8/h2-5H,10H2,1H3
InChIKeyXLQZUWYFIKPFAR-UHFFFAOYSA-N
MW207.26 g/mol
LogP1.09
Rot. Bonds1

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

5-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one (PubChem CID 58710057) has the molecular formula C9H9N3OS and a molecular weight of 207.26 g/mol. Its IUPAC name is 5-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one.

Molecular Properties

Compound Name5-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one
PubChem CID58710057
Molecular FormulaC9H9N3OS
Molecular Weight207.26 g/mol
Exact Mass207.05
IUPAC Name5-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one
SMILESCn1cc(N)cc(-c2cncs2)c1=O
InChIInChI=1S/C9H9N3OS/c1-12-4-6(10)2-7(9(12)13)8-3-11-5-14-8/h2-5H,10H2,1H3
InChIKeyXLQZUWYFIKPFAR-UHFFFAOYSA-N
XLogP1.09
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.26
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one 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-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one?
The IUPAC name of 5-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one (CID 58710057) is 5-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one.
What is the SMILES notation for 5-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one?
The canonical SMILES for 5-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one is Cn1cc(N)cc(-c2cncs2)c1=O.
What is the InChIKey of 5-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one?
The InChIKey is XLQZUWYFIKPFAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3OS/c1-12-4-6(10)2-7(9(12)13)8-3-11-5-14-8/h2-5H,10H2,1H3.
What are the key properties of 5-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one?
5-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one has a molecular weight of 207.26 g/mol, XLogP of 1.09, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-methyl-3-(1,3-thiazol-5-yl)pyridin-2-one is sourced from PubChem (CID 58710057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).