2-(2H-oxet-2-yl)piperidine

C8H13NO — CID 150407641

IUPAC2-(2H-oxet-2-yl)piperidine
SMILESC1=CC(C2CCCCN2)O1
InChIInChI=1S/C8H13NO/c1-2-5-9-7(3-1)8-4-6-10-8/h4,6-9H,1-3,5H2
InChIKeyHFCMTENFPRDQCW-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.04
Rot. Bonds1

About 2-(2H-oxet-2-yl)piperidine

2-(2H-oxet-2-yl)piperidine (PubChem CID 150407641) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is 2-(2H-oxet-2-yl)piperidine.

Molecular Properties

Compound Name2-(2H-oxet-2-yl)piperidine
PubChem CID150407641
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Name2-(2H-oxet-2-yl)piperidine
SMILESC1=CC(C2CCCCN2)O1
InChIInChI=1S/C8H13NO/c1-2-5-9-7(3-1)8-4-6-10-8/h4,6-9H,1-3,5H2
InChIKeyHFCMTENFPRDQCW-UHFFFAOYSA-N
XLogP1.04
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2H-oxet-2-yl)piperidine?
The IUPAC name of 2-(2H-oxet-2-yl)piperidine (CID 150407641) is 2-(2H-oxet-2-yl)piperidine.
What is the SMILES notation for 2-(2H-oxet-2-yl)piperidine?
The canonical SMILES for 2-(2H-oxet-2-yl)piperidine is C1=CC(C2CCCCN2)O1.
What is the InChIKey of 2-(2H-oxet-2-yl)piperidine?
The InChIKey is HFCMTENFPRDQCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-2-5-9-7(3-1)8-4-6-10-8/h4,6-9H,1-3,5H2.
What are the key properties of 2-(2H-oxet-2-yl)piperidine?
2-(2H-oxet-2-yl)piperidine has a molecular weight of 139.20 g/mol, XLogP of 1.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2H-oxet-2-yl)piperidine is sourced from PubChem (CID 150407641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).