3-(oxetan-3-yl)piperidine

C8H15NO — CID 90946677

IUPAC3-(oxetan-3-yl)piperidine
SMILESC1CNCC(C2COC2)C1
InChIInChI=1S/C8H15NO/c1-2-7(4-9-3-1)8-5-10-6-8/h7-9H,1-6H2
InChIKeyTYQKZPRIQBPBFV-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.63
Rot. Bonds1

About 3-(oxetan-3-yl)piperidine

3-(oxetan-3-yl)piperidine (PubChem CID 90946677) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 3-(oxetan-3-yl)piperidine.

Molecular Properties

Compound Name3-(oxetan-3-yl)piperidine
PubChem CID90946677
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name3-(oxetan-3-yl)piperidine
SMILESC1CNCC(C2COC2)C1
InChIInChI=1S/C8H15NO/c1-2-7(4-9-3-1)8-5-10-6-8/h7-9H,1-6H2
InChIKeyTYQKZPRIQBPBFV-UHFFFAOYSA-N
XLogP0.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(oxetan-3-yl)piperidine?
The IUPAC name of 3-(oxetan-3-yl)piperidine (CID 90946677) is 3-(oxetan-3-yl)piperidine.
What is the SMILES notation for 3-(oxetan-3-yl)piperidine?
The canonical SMILES for 3-(oxetan-3-yl)piperidine is C1CNCC(C2COC2)C1.
What is the InChIKey of 3-(oxetan-3-yl)piperidine?
The InChIKey is TYQKZPRIQBPBFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-2-7(4-9-3-1)8-5-10-6-8/h7-9H,1-6H2.
What are the key properties of 3-(oxetan-3-yl)piperidine?
3-(oxetan-3-yl)piperidine has a molecular weight of 141.21 g/mol, XLogP of 0.63, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(oxetan-3-yl)piperidine is sourced from PubChem (CID 90946677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).