1-(oxetan-3-yl)-4-propan-2-ylpiperidine

C11H21NO — CID 58054341

IUPAC1-(oxetan-3-yl)-4-propan-2-ylpiperidine
SMILESCC(C)C1CCN(C2COC2)CC1
InChIInChI=1S/C11H21NO/c1-9(2)10-3-5-12(6-4-10)11-7-13-8-11/h9-11H,3-8H2,1-2H3
InChIKeyHIAWNGIPMXNJLR-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.75
Rot. Bonds2

About 1-(oxetan-3-yl)-4-propan-2-ylpiperidine

1-(oxetan-3-yl)-4-propan-2-ylpiperidine (PubChem CID 58054341) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 1-(oxetan-3-yl)-4-propan-2-ylpiperidine.

Molecular Properties

Compound Name1-(oxetan-3-yl)-4-propan-2-ylpiperidine
PubChem CID58054341
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name1-(oxetan-3-yl)-4-propan-2-ylpiperidine
SMILESCC(C)C1CCN(C2COC2)CC1
InChIInChI=1S/C11H21NO/c1-9(2)10-3-5-12(6-4-10)11-7-13-8-11/h9-11H,3-8H2,1-2H3
InChIKeyHIAWNGIPMXNJLR-UHFFFAOYSA-N
XLogP1.75
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(oxetan-3-yl)-4-propan-2-ylpiperidine?
The IUPAC name of 1-(oxetan-3-yl)-4-propan-2-ylpiperidine (CID 58054341) is 1-(oxetan-3-yl)-4-propan-2-ylpiperidine.
What is the SMILES notation for 1-(oxetan-3-yl)-4-propan-2-ylpiperidine?
The canonical SMILES for 1-(oxetan-3-yl)-4-propan-2-ylpiperidine is CC(C)C1CCN(C2COC2)CC1.
What is the InChIKey of 1-(oxetan-3-yl)-4-propan-2-ylpiperidine?
The InChIKey is HIAWNGIPMXNJLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-9(2)10-3-5-12(6-4-10)11-7-13-8-11/h9-11H,3-8H2,1-2H3.
What are the key properties of 1-(oxetan-3-yl)-4-propan-2-ylpiperidine?
1-(oxetan-3-yl)-4-propan-2-ylpiperidine has a molecular weight of 183.29 g/mol, XLogP of 1.75, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxetan-3-yl)-4-propan-2-ylpiperidine is sourced from PubChem (CID 58054341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).