2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole

C11H7N3OS — CID 138376878

IUPAC2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole
SMILESc1cc(-c2ncco2)nc(-c2nccs2)c1
InChIInChI=1S/C11H7N3OS/c1-2-8(10-12-4-6-15-10)14-9(3-1)11-13-5-7-16-11/h1-7H
InChIKeyXGRDOMVKIUROIF-UHFFFAOYSA-N
MW229.26 g/mol
LogP2.86
Rot. Bonds2

About 2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole

2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole (PubChem CID 138376878) has the molecular formula C11H7N3OS and a molecular weight of 229.26 g/mol. Its IUPAC name is 2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole.

Molecular Properties

Compound Name2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole
PubChem CID138376878
Molecular FormulaC11H7N3OS
Molecular Weight229.26 g/mol
Exact Mass229.03
IUPAC Name2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole
SMILESc1cc(-c2ncco2)nc(-c2nccs2)c1
InChIInChI=1S/C11H7N3OS/c1-2-8(10-12-4-6-15-10)14-9(3-1)11-13-5-7-16-11/h1-7H
InChIKeyXGRDOMVKIUROIF-UHFFFAOYSA-N
XLogP2.86
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.26
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole?
The IUPAC name of 2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole (CID 138376878) is 2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole.
What is the SMILES notation for 2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole?
The canonical SMILES for 2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole is c1cc(-c2ncco2)nc(-c2nccs2)c1.
What is the InChIKey of 2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole?
The InChIKey is XGRDOMVKIUROIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N3OS/c1-2-8(10-12-4-6-15-10)14-9(3-1)11-13-5-7-16-11/h1-7H.
What are the key properties of 2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole?
2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole has a molecular weight of 229.26 g/mol, XLogP of 2.86, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-oxazole is sourced from PubChem (CID 138376878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).