3-fluoro-1-(oxetan-3-yl)piperidine

C8H14FNO — CID 123854958

IUPAC3-fluoro-1-(oxetan-3-yl)piperidine
SMILESFC1CCCN(C2COC2)C1
InChIInChI=1S/C8H14FNO/c9-7-2-1-3-10(4-7)8-5-11-6-8/h7-8H,1-6H2
InChIKeyJHSRZAYBUCTJGJ-UHFFFAOYSA-N
MW159.20 g/mol
LogP0.82
Rot. Bonds1

About 3-fluoro-1-(oxetan-3-yl)piperidine

3-fluoro-1-(oxetan-3-yl)piperidine (PubChem CID 123854958) has the molecular formula C8H14FNO and a molecular weight of 159.20 g/mol. Its IUPAC name is 3-fluoro-1-(oxetan-3-yl)piperidine.

Molecular Properties

Compound Name3-fluoro-1-(oxetan-3-yl)piperidine
PubChem CID123854958
Molecular FormulaC8H14FNO
Molecular Weight159.20 g/mol
Exact Mass159.11
IUPAC Name3-fluoro-1-(oxetan-3-yl)piperidine
SMILESFC1CCCN(C2COC2)C1
InChIInChI=1S/C8H14FNO/c9-7-2-1-3-10(4-7)8-5-11-6-8/h7-8H,1-6H2
InChIKeyJHSRZAYBUCTJGJ-UHFFFAOYSA-N
XLogP0.82
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.20
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-1-(oxetan-3-yl)piperidine?
The IUPAC name of 3-fluoro-1-(oxetan-3-yl)piperidine (CID 123854958) is 3-fluoro-1-(oxetan-3-yl)piperidine.
What is the SMILES notation for 3-fluoro-1-(oxetan-3-yl)piperidine?
The canonical SMILES for 3-fluoro-1-(oxetan-3-yl)piperidine is FC1CCCN(C2COC2)C1.
What is the InChIKey of 3-fluoro-1-(oxetan-3-yl)piperidine?
The InChIKey is JHSRZAYBUCTJGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FNO/c9-7-2-1-3-10(4-7)8-5-11-6-8/h7-8H,1-6H2.
What are the key properties of 3-fluoro-1-(oxetan-3-yl)piperidine?
3-fluoro-1-(oxetan-3-yl)piperidine has a molecular weight of 159.20 g/mol, XLogP of 0.82, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-1-(oxetan-3-yl)piperidine is sourced from PubChem (CID 123854958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).