4-(oxan-2-ylmethoxy)piperidine

C11H21NO2 — CID 24711490

IUPAC4-(oxan-2-ylmethoxy)piperidine
SMILESC1CCC(COC2CCNCC2)OC1
InChIInChI=1S/C11H21NO2/c1-2-8-13-11(3-1)9-14-10-4-6-12-7-5-10/h10-12H,1-9H2
InChIKeyYHARXZQFMJHMJT-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.32
Rot. Bonds3

About 4-(oxan-2-ylmethoxy)piperidine

4-(oxan-2-ylmethoxy)piperidine (PubChem CID 24711490) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 4-(oxan-2-ylmethoxy)piperidine.

Molecular Properties

Compound Name4-(oxan-2-ylmethoxy)piperidine
PubChem CID24711490
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name4-(oxan-2-ylmethoxy)piperidine
SMILESC1CCC(COC2CCNCC2)OC1
InChIInChI=1S/C11H21NO2/c1-2-8-13-11(3-1)9-14-10-4-6-12-7-5-10/h10-12H,1-9H2
InChIKeyYHARXZQFMJHMJT-UHFFFAOYSA-N
XLogP1.32
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(oxan-2-ylmethoxy)piperidine?
The IUPAC name of 4-(oxan-2-ylmethoxy)piperidine (CID 24711490) is 4-(oxan-2-ylmethoxy)piperidine.
What is the SMILES notation for 4-(oxan-2-ylmethoxy)piperidine?
The canonical SMILES for 4-(oxan-2-ylmethoxy)piperidine is C1CCC(COC2CCNCC2)OC1.
What is the InChIKey of 4-(oxan-2-ylmethoxy)piperidine?
The InChIKey is YHARXZQFMJHMJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-2-8-13-11(3-1)9-14-10-4-6-12-7-5-10/h10-12H,1-9H2.
What are the key properties of 4-(oxan-2-ylmethoxy)piperidine?
4-(oxan-2-ylmethoxy)piperidine has a molecular weight of 199.29 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxan-2-ylmethoxy)piperidine is sourced from PubChem (CID 24711490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).