5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole

C11H10N2O3 — CID 10560747

IUPAC5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole
SMILESc1cc(-c2cnco2)nc(C2OCCO2)c1
InChIInChI=1S/C11H10N2O3/c1-2-8(10-6-12-7-16-10)13-9(3-1)11-14-4-5-15-11/h1-3,6-7,11H,4-5H2
InChIKeyRIGYMLDOYLUWKN-UHFFFAOYSA-N
MW218.21 g/mol
LogP1.78
Rot. Bonds2

About 5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole

5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole (PubChem CID 10560747) has the molecular formula C11H10N2O3 and a molecular weight of 218.21 g/mol. Its IUPAC name is 5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole.

Molecular Properties

Compound Name5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole
PubChem CID10560747
Molecular FormulaC11H10N2O3
Molecular Weight218.21 g/mol
Exact Mass218.07
IUPAC Name5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole
SMILESc1cc(-c2cnco2)nc(C2OCCO2)c1
InChIInChI=1S/C11H10N2O3/c1-2-8(10-6-12-7-16-10)13-9(3-1)11-14-4-5-15-11/h1-3,6-7,11H,4-5H2
InChIKeyRIGYMLDOYLUWKN-UHFFFAOYSA-N
XLogP1.78
TPSA57.38 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole?
The IUPAC name of 5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole (CID 10560747) is 5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole.
What is the SMILES notation for 5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole?
The canonical SMILES for 5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole is c1cc(-c2cnco2)nc(C2OCCO2)c1.
What is the InChIKey of 5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole?
The InChIKey is RIGYMLDOYLUWKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3/c1-2-8(10-6-12-7-16-10)13-9(3-1)11-14-4-5-15-11/h1-3,6-7,11H,4-5H2.
What are the key properties of 5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole?
5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole has a molecular weight of 218.21 g/mol, XLogP of 1.78, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(1,3-dioxolan-2-yl)-2-pyridinyl]-1,3-oxazole is sourced from PubChem (CID 10560747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).