3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine

C14H12ClFN2O2 — CID 53324709

IUPAC3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine
SMILESFc1cccc(Cl)c1Oc1ncccc1OC1CNC1
InChIInChI=1S/C14H12ClFN2O2/c15-10-3-1-4-11(16)13(10)20-14-12(5-2-6-18-14)19-9-7-17-8-9/h1-6,9,17H,7-8H2
InChIKeyKCIORJWXNLIEPL-UHFFFAOYSA-N
MW294.71 g/mol
LogP3.02
Rot. Bonds4

About 3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine

3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine (PubChem CID 53324709) has the molecular formula C14H12ClFN2O2 and a molecular weight of 294.71 g/mol. Its IUPAC name is 3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine.

Molecular Properties

Compound Name3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine
PubChem CID53324709
Molecular FormulaC14H12ClFN2O2
Molecular Weight294.71 g/mol
Exact Mass294.06
IUPAC Name3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine
SMILESFc1cccc(Cl)c1Oc1ncccc1OC1CNC1
InChIInChI=1S/C14H12ClFN2O2/c15-10-3-1-4-11(16)13(10)20-14-12(5-2-6-18-14)19-9-7-17-8-9/h1-6,9,17H,7-8H2
InChIKeyKCIORJWXNLIEPL-UHFFFAOYSA-N
XLogP3.02
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.71
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine?
The IUPAC name of 3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine (CID 53324709) is 3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine.
What is the SMILES notation for 3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine?
The canonical SMILES for 3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine is Fc1cccc(Cl)c1Oc1ncccc1OC1CNC1.
What is the InChIKey of 3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine?
The InChIKey is KCIORJWXNLIEPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClFN2O2/c15-10-3-1-4-11(16)13(10)20-14-12(5-2-6-18-14)19-9-7-17-8-9/h1-6,9,17H,7-8H2.
What are the key properties of 3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine?
3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine has a molecular weight of 294.71 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine is sourced from PubChem (CID 53324709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).