2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole

C9H7FN2OS — CID 158110284

IUPAC2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole
SMILESCOc1cnc(-c2cncc(F)c2)s1
InChIInChI=1S/C9H7FN2OS/c1-13-8-5-12-9(14-8)6-2-7(10)4-11-3-6/h2-5H,1H3
InChIKeyDSFWFNJCPKBUMC-UHFFFAOYSA-N
MW210.23 g/mol
LogP2.35
Rot. Bonds2

About 2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole

2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole (PubChem CID 158110284) has the molecular formula C9H7FN2OS and a molecular weight of 210.23 g/mol. Its IUPAC name is 2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole.

Molecular Properties

Compound Name2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole
PubChem CID158110284
Molecular FormulaC9H7FN2OS
Molecular Weight210.23 g/mol
Exact Mass210.03
IUPAC Name2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole
SMILESCOc1cnc(-c2cncc(F)c2)s1
InChIInChI=1S/C9H7FN2OS/c1-13-8-5-12-9(14-8)6-2-7(10)4-11-3-6/h2-5H,1H3
InChIKeyDSFWFNJCPKBUMC-UHFFFAOYSA-N
XLogP2.35
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole?
The IUPAC name of 2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole (CID 158110284) is 2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole.
What is the SMILES notation for 2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole?
The canonical SMILES for 2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole is COc1cnc(-c2cncc(F)c2)s1.
What is the InChIKey of 2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole?
The InChIKey is DSFWFNJCPKBUMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7FN2OS/c1-13-8-5-12-9(14-8)6-2-7(10)4-11-3-6/h2-5H,1H3.
What are the key properties of 2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole?
2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole has a molecular weight of 210.23 g/mol, XLogP of 2.35, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-3-pyridinyl)-5-methoxy-1,3-thiazole is sourced from PubChem (CID 158110284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).