2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine

C13H16N2O2 — CID 58547700

IUPAC2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine
SMILESC1=C(c2cccnc2OC2CNC2)CCOC1
InChIInChI=1S/C13H16N2O2/c1-2-12(10-3-6-16-7-4-10)13(15-5-1)17-11-8-14-9-11/h1-3,5,11,14H,4,6-9H2
InChIKeyJFCTUOYRYZAODZ-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.24
Rot. Bonds3

About 2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine

2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine (PubChem CID 58547700) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine.

Molecular Properties

Compound Name2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine
PubChem CID58547700
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine
SMILESC1=C(c2cccnc2OC2CNC2)CCOC1
InChIInChI=1S/C13H16N2O2/c1-2-12(10-3-6-16-7-4-10)13(15-5-1)17-11-8-14-9-11/h1-3,5,11,14H,4,6-9H2
InChIKeyJFCTUOYRYZAODZ-UHFFFAOYSA-N
XLogP1.24
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine?
The IUPAC name of 2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine (CID 58547700) is 2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine.
What is the SMILES notation for 2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine?
The canonical SMILES for 2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine is C1=C(c2cccnc2OC2CNC2)CCOC1.
What is the InChIKey of 2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine?
The InChIKey is JFCTUOYRYZAODZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-2-12(10-3-6-16-7-4-10)13(15-5-1)17-11-8-14-9-11/h1-3,5,11,14H,4,6-9H2.
What are the key properties of 2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine?
2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine has a molecular weight of 232.28 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yloxy)-3-(3,6-dihydro-2H-pyran-4-yl)pyridine is sourced from PubChem (CID 58547700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).