3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine

C10H11F3N2O — CID 171552910

IUPAC3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine
SMILESFC(F)(F)COc1cncc(N2CCC2)c1
InChIInChI=1S/C10H11F3N2O/c11-10(12,13)7-16-9-4-8(5-14-6-9)15-2-1-3-15/h4-6H,1-3,7H2
InChIKeyHYWBZADPPPFFGI-UHFFFAOYSA-N
MW232.20 g/mol
LogP2.23
Rot. Bonds3

About 3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine

3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine (PubChem CID 171552910) has the molecular formula C10H11F3N2O and a molecular weight of 232.20 g/mol. Its IUPAC name is 3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine.

Molecular Properties

Compound Name3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine
PubChem CID171552910
Molecular FormulaC10H11F3N2O
Molecular Weight232.20 g/mol
Exact Mass232.08
IUPAC Name3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine
SMILESFC(F)(F)COc1cncc(N2CCC2)c1
InChIInChI=1S/C10H11F3N2O/c11-10(12,13)7-16-9-4-8(5-14-6-9)15-2-1-3-15/h4-6H,1-3,7H2
InChIKeyHYWBZADPPPFFGI-UHFFFAOYSA-N
XLogP2.23
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.20
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine?
The IUPAC name of 3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine (CID 171552910) is 3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine.
What is the SMILES notation for 3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine?
The canonical SMILES for 3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine is FC(F)(F)COc1cncc(N2CCC2)c1.
What is the InChIKey of 3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine?
The InChIKey is HYWBZADPPPFFGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O/c11-10(12,13)7-16-9-4-8(5-14-6-9)15-2-1-3-15/h4-6H,1-3,7H2.
What are the key properties of 3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine?
3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine has a molecular weight of 232.20 g/mol, XLogP of 2.23, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(azetidin-1-yl)-5-(2,2,2-trifluoroethoxy)pyridine is sourced from PubChem (CID 171552910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).