4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine

C12H15NO2 — CID 139464706

IUPAC4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine
SMILESC=Cc1ccnc(C2(OC)CCOC2)c1
InChIInChI=1S/C12H15NO2/c1-3-10-4-6-13-11(8-10)12(14-2)5-7-15-9-12/h3-4,6,8H,1,5,7,9H2,2H3
InChIKeyOJFKDRGYOHEDQN-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.99
Rot. Bonds3

About 4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine

4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine (PubChem CID 139464706) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is 4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine.

Molecular Properties

Compound Name4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine
PubChem CID139464706
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine
SMILESC=Cc1ccnc(C2(OC)CCOC2)c1
InChIInChI=1S/C12H15NO2/c1-3-10-4-6-13-11(8-10)12(14-2)5-7-15-9-12/h3-4,6,8H,1,5,7,9H2,2H3
InChIKeyOJFKDRGYOHEDQN-UHFFFAOYSA-N
XLogP1.99
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine?
The IUPAC name of 4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine (CID 139464706) is 4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine.
What is the SMILES notation for 4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine?
The canonical SMILES for 4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine is C=Cc1ccnc(C2(OC)CCOC2)c1.
What is the InChIKey of 4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine?
The InChIKey is OJFKDRGYOHEDQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-3-10-4-6-13-11(8-10)12(14-2)5-7-15-9-12/h3-4,6,8H,1,5,7,9H2,2H3.
What are the key properties of 4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine?
4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine has a molecular weight of 205.26 g/mol, XLogP of 1.99, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-2-(3-methoxyoxolan-3-yl)pyridine is sourced from PubChem (CID 139464706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).