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

C8H5FN2S — CID 66633860

IUPAC2-(5-fluoro-3-pyridinyl)-1,3-thiazole
SMILESFc1cncc(-c2nccs2)c1
InChIInChI=1S/C8H5FN2S/c9-7-3-6(4-10-5-7)8-11-1-2-12-8/h1-5H
InChIKeySFCMGVYOWNFDPX-UHFFFAOYSA-N
MW180.21 g/mol
LogP2.34
Rot. Bonds1

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

2-(5-fluoro-3-pyridinyl)-1,3-thiazole (PubChem CID 66633860) has the molecular formula C8H5FN2S and a molecular weight of 180.21 g/mol. Its IUPAC name is 2-(5-fluoro-3-pyridinyl)-1,3-thiazole.

Molecular Properties

Compound Name2-(5-fluoro-3-pyridinyl)-1,3-thiazole
PubChem CID66633860
Molecular FormulaC8H5FN2S
Molecular Weight180.21 g/mol
Exact Mass180.02
IUPAC Name2-(5-fluoro-3-pyridinyl)-1,3-thiazole
SMILESFc1cncc(-c2nccs2)c1
InChIInChI=1S/C8H5FN2S/c9-7-3-6(4-10-5-7)8-11-1-2-12-8/h1-5H
InChIKeySFCMGVYOWNFDPX-UHFFFAOYSA-N
XLogP2.34
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-3-pyridinyl)-1,3-thiazole?
The IUPAC name of 2-(5-fluoro-3-pyridinyl)-1,3-thiazole (CID 66633860) is 2-(5-fluoro-3-pyridinyl)-1,3-thiazole.
What is the SMILES notation for 2-(5-fluoro-3-pyridinyl)-1,3-thiazole?
The canonical SMILES for 2-(5-fluoro-3-pyridinyl)-1,3-thiazole is Fc1cncc(-c2nccs2)c1.
What is the InChIKey of 2-(5-fluoro-3-pyridinyl)-1,3-thiazole?
The InChIKey is SFCMGVYOWNFDPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5FN2S/c9-7-3-6(4-10-5-7)8-11-1-2-12-8/h1-5H.
What are the key properties of 2-(5-fluoro-3-pyridinyl)-1,3-thiazole?
2-(5-fluoro-3-pyridinyl)-1,3-thiazole has a molecular weight of 180.21 g/mol, XLogP of 2.34, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-3-pyridinyl)-1,3-thiazole is sourced from PubChem (CID 66633860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).