3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one

C8H6FN3OS — CID 137449785

IUPAC3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one
SMILESNc1c(F)ccn(-c2nccs2)c1=O
InChIInChI=1S/C8H6FN3OS/c9-5-1-3-12(7(13)6(5)10)8-11-2-4-14-8/h1-4H,10H2
InChIKeyKNYXSLCGNOJKJT-UHFFFAOYSA-N
MW211.22 g/mol
LogP1.02
Rot. Bonds1

About 3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one

3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one (PubChem CID 137449785) has the molecular formula C8H6FN3OS and a molecular weight of 211.22 g/mol. Its IUPAC name is 3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one.

Molecular Properties

Compound Name3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one
PubChem CID137449785
Molecular FormulaC8H6FN3OS
Molecular Weight211.22 g/mol
Exact Mass211.02
IUPAC Name3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one
SMILESNc1c(F)ccn(-c2nccs2)c1=O
InChIInChI=1S/C8H6FN3OS/c9-5-1-3-12(7(13)6(5)10)8-11-2-4-14-8/h1-4H,10H2
InChIKeyKNYXSLCGNOJKJT-UHFFFAOYSA-N
XLogP1.02
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one?
The IUPAC name of 3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one (CID 137449785) is 3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one.
What is the SMILES notation for 3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one?
The canonical SMILES for 3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one is Nc1c(F)ccn(-c2nccs2)c1=O.
What is the InChIKey of 3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one?
The InChIKey is KNYXSLCGNOJKJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FN3OS/c9-5-1-3-12(7(13)6(5)10)8-11-2-4-14-8/h1-4H,10H2.
What are the key properties of 3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one?
3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one has a molecular weight of 211.22 g/mol, XLogP of 1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-fluoro-1-(1,3-thiazol-2-yl)pyridin-2-one is sourced from PubChem (CID 137449785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).