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

C13H8FN3S — CID 141335378

IUPAC2-(5-fluoro-3-pyridinyl)-5-pyridin-2-yl-1,3-thiazole
SMILESFc1cncc(-c2ncc(-c3ccccn3)s2)c1
InChIInChI=1S/C13H8FN3S/c14-10-5-9(6-15-7-10)13-17-8-12(18-13)11-3-1-2-4-16-11/h1-8H
InChIKeyAKWKUKIQHPCWKK-UHFFFAOYSA-N
MW257.29 g/mol
LogP3.41
Rot. Bonds2

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

2-(5-fluoro-3-pyridinyl)-5-pyridin-2-yl-1,3-thiazole (PubChem CID 141335378) has the molecular formula C13H8FN3S and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-(5-fluoro-3-pyridinyl)-5-pyridin-2-yl-1,3-thiazole.

Molecular Properties

Compound Name2-(5-fluoro-3-pyridinyl)-5-pyridin-2-yl-1,3-thiazole
PubChem CID141335378
Molecular FormulaC13H8FN3S
Molecular Weight257.29 g/mol
Exact Mass257.04
IUPAC Name2-(5-fluoro-3-pyridinyl)-5-pyridin-2-yl-1,3-thiazole
SMILESFc1cncc(-c2ncc(-c3ccccn3)s2)c1
InChIInChI=1S/C13H8FN3S/c14-10-5-9(6-15-7-10)13-17-8-12(18-13)11-3-1-2-4-16-11/h1-8H
InChIKeyAKWKUKIQHPCWKK-UHFFFAOYSA-N
XLogP3.41
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 53.41
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-pyridin-2-yl-1,3-thiazole?
The IUPAC name of 2-(5-fluoro-3-pyridinyl)-5-pyridin-2-yl-1,3-thiazole (CID 141335378) is 2-(5-fluoro-3-pyridinyl)-5-pyridin-2-yl-1,3-thiazole.
What is the SMILES notation for 2-(5-fluoro-3-pyridinyl)-5-pyridin-2-yl-1,3-thiazole?
The canonical SMILES for 2-(5-fluoro-3-pyridinyl)-5-pyridin-2-yl-1,3-thiazole is Fc1cncc(-c2ncc(-c3ccccn3)s2)c1.
What is the InChIKey of 2-(5-fluoro-3-pyridinyl)-5-pyridin-2-yl-1,3-thiazole?
The InChIKey is AKWKUKIQHPCWKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8FN3S/c14-10-5-9(6-15-7-10)13-17-8-12(18-13)11-3-1-2-4-16-11/h1-8H.
What are the key properties of 2-(5-fluoro-3-pyridinyl)-5-pyridin-2-yl-1,3-thiazole?
2-(5-fluoro-3-pyridinyl)-5-pyridin-2-yl-1,3-thiazole has a molecular weight of 257.29 g/mol, XLogP of 3.41, 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-pyridin-2-yl-1,3-thiazole is sourced from PubChem (CID 141335378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).