1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone

C10H7FN2OS — CID 79712444

IUPAC1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone
SMILESCC(=O)c1csc(-c2ccc(F)cn2)n1
InChIInChI=1S/C10H7FN2OS/c1-6(14)9-5-15-10(13-9)8-3-2-7(11)4-12-8/h2-5H,1H3
InChIKeyHBWDCVNSOVIGSX-UHFFFAOYSA-N
MW222.24 g/mol
LogP2.55
Rot. Bonds2

About 1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone

1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone (PubChem CID 79712444) has the molecular formula C10H7FN2OS and a molecular weight of 222.24 g/mol. Its IUPAC name is 1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone.

Molecular Properties

Compound Name1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone
PubChem CID79712444
Molecular FormulaC10H7FN2OS
Molecular Weight222.24 g/mol
Exact Mass222.03
IUPAC Name1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone
SMILESCC(=O)c1csc(-c2ccc(F)cn2)n1
InChIInChI=1S/C10H7FN2OS/c1-6(14)9-5-15-10(13-9)8-3-2-7(11)4-12-8/h2-5H,1H3
InChIKeyHBWDCVNSOVIGSX-UHFFFAOYSA-N
XLogP2.55
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethanone
CID 64542603
1-[5-(5-fluoro-2-pyridinyl)-2-pyridinyl]ethanone
CID 59162014
4-(chloromethyl)-2-(5-fluoro-2-pyridinyl)-1,3-thiazole
CID 79719140
1-[2-(1-methylpyrazol-3-yl)-1,3-thiazol-4-yl]ethanone
CID 65198190
1-[2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]ethanone
CID 2745414
1-[2-(4-fluoro-3-methylphenyl)-1,3-thiazol-4-yl]ethanone
CID 64543606
2-bromo-4-(5-fluoro-2-pyridinyl)-1,3-thiazole
CID 112623637
1-[2-(2-chloro-6-fluorophenyl)-1,3-thiazol-4-yl]ethanone
CID 64542794
1-(2-quinolin-4-yl-1,3-thiazol-4-yl)ethanone
CID 64542810
1-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanone
CID 22888692
1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanone
CID 64770332
2-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]-1-phenylethanol
CID 79712451

Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone?
The IUPAC name of 1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone (CID 79712444) is 1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone.
What is the SMILES notation for 1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone?
The canonical SMILES for 1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone is CC(=O)c1csc(-c2ccc(F)cn2)n1.
What is the InChIKey of 1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone?
The InChIKey is HBWDCVNSOVIGSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FN2OS/c1-6(14)9-5-15-10(13-9)8-3-2-7(11)4-12-8/h2-5H,1H3.
What are the key properties of 1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone?
1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone has a molecular weight of 222.24 g/mol, XLogP of 2.55, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-fluoro-2-pyridinyl)-1,3-thiazol-4-yl]ethanone is sourced from PubChem (CID 79712444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).