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

C10H19NO — CID 126995584

IUPAC3-ethyl-1-(oxetan-3-yl)piperidine
SMILESCCC1CCCN(C2COC2)C1
InChIInChI=1S/C10H19NO/c1-2-9-4-3-5-11(6-9)10-7-12-8-10/h9-10H,2-8H2,1H3
InChIKeyULXGABFTGFYZMO-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.51
Rot. Bonds2

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

3-ethyl-1-(oxetan-3-yl)piperidine (PubChem CID 126995584) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 3-ethyl-1-(oxetan-3-yl)piperidine.

Molecular Properties

Compound Name3-ethyl-1-(oxetan-3-yl)piperidine
PubChem CID126995584
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name3-ethyl-1-(oxetan-3-yl)piperidine
SMILESCCC1CCCN(C2COC2)C1
InChIInChI=1S/C10H19NO/c1-2-9-4-3-5-11(6-9)10-7-12-8-10/h9-10H,2-8H2,1H3
InChIKeyULXGABFTGFYZMO-UHFFFAOYSA-N
XLogP1.51
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(oxetan-3-yl)piperidine?
The IUPAC name of 3-ethyl-1-(oxetan-3-yl)piperidine (CID 126995584) is 3-ethyl-1-(oxetan-3-yl)piperidine.
What is the SMILES notation for 3-ethyl-1-(oxetan-3-yl)piperidine?
The canonical SMILES for 3-ethyl-1-(oxetan-3-yl)piperidine is CCC1CCCN(C2COC2)C1.
What is the InChIKey of 3-ethyl-1-(oxetan-3-yl)piperidine?
The InChIKey is ULXGABFTGFYZMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-2-9-4-3-5-11(6-9)10-7-12-8-10/h9-10H,2-8H2,1H3.
What are the key properties of 3-ethyl-1-(oxetan-3-yl)piperidine?
3-ethyl-1-(oxetan-3-yl)piperidine has a molecular weight of 169.27 g/mol, XLogP of 1.51, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(oxetan-3-yl)piperidine is sourced from PubChem (CID 126995584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).