3-(oxan-4-yloxy)piperidine;hydrochloride

C10H20ClNO2 — CID 167716540

IUPAC3-(oxan-4-yloxy)piperidine;hydrochloride
SMILESC1CNCC(OC2CCOCC2)C1.Cl
InChIInChI=1S/C10H19NO2.ClH/c1-2-10(8-11-5-1)13-9-3-6-12-7-4-9;/h9-11H,1-8H2;1H
InChIKeyNUHVGDHWKCBYCT-UHFFFAOYSA-N
MW221.73 g/mol
LogP1.36
Rot. Bonds2

About 3-(oxan-4-yloxy)piperidine;hydrochloride

3-(oxan-4-yloxy)piperidine;hydrochloride (PubChem CID 167716540) has the molecular formula C10H20ClNO2 and a molecular weight of 221.73 g/mol. Its IUPAC name is 3-(oxan-4-yloxy)piperidine;hydrochloride.

Molecular Properties

Compound Name3-(oxan-4-yloxy)piperidine;hydrochloride
PubChem CID167716540
Molecular FormulaC10H20ClNO2
Molecular Weight221.73 g/mol
Exact Mass221.12
IUPAC Name3-(oxan-4-yloxy)piperidine;hydrochloride
SMILESC1CNCC(OC2CCOCC2)C1.Cl
InChIInChI=1S/C10H19NO2.ClH/c1-2-10(8-11-5-1)13-9-3-6-12-7-4-9;/h9-11H,1-8H2;1H
InChIKeyNUHVGDHWKCBYCT-UHFFFAOYSA-N
XLogP1.36
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.73
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-[(3R)-piperidin-3-yl]oxypiperidine
CID 142756272
3-methoxypiperidine;hydrochloride
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3-(1-oxa-9-thiaspiro[5.5]undecan-4-yloxy)piperidine
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(4R)-4-cyclobutyloxyazepane
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3-(azetidin-3-yloxy)pyrrolidine;dihydrochloride
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(3S)-3-methoxypiperidine;sulfane;hydrochloride
CID 157461038
4-[(3R)-oxolan-3-yl]oxypiperidine
CID 95305973
3-[2-(oxan-4-yl)ethyl]piperidine;hydrochloride
CID 126845728
2-[(3S)-piperidin-3-yl]oxycyclopentan-1-ol
CID 106940503
3-propan-2-yloxypiperidine;hydrochloride
CID 53409755
3-(5-oxaspiro[3.5]nonan-8-yloxy)pyrrolidine
CID 79894162
3-(oxan-4-ylmethoxymethyl)piperidine
CID 62383187

Frequently Asked Questions

What is the IUPAC name of 3-(oxan-4-yloxy)piperidine;hydrochloride?
The IUPAC name of 3-(oxan-4-yloxy)piperidine;hydrochloride (CID 167716540) is 3-(oxan-4-yloxy)piperidine;hydrochloride.
What is the SMILES notation for 3-(oxan-4-yloxy)piperidine;hydrochloride?
The canonical SMILES for 3-(oxan-4-yloxy)piperidine;hydrochloride is C1CNCC(OC2CCOCC2)C1.Cl.
What is the InChIKey of 3-(oxan-4-yloxy)piperidine;hydrochloride?
The InChIKey is NUHVGDHWKCBYCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2.ClH/c1-2-10(8-11-5-1)13-9-3-6-12-7-4-9;/h9-11H,1-8H2;1H.
What are the key properties of 3-(oxan-4-yloxy)piperidine;hydrochloride?
3-(oxan-4-yloxy)piperidine;hydrochloride has a molecular weight of 221.73 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(oxan-4-yloxy)piperidine;hydrochloride is sourced from PubChem (CID 167716540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).