4-(oxolan-2-ylmethoxy)piperidine;hydrochloride

C10H20ClNO2 — CID 45074945

IUPAC4-(oxolan-2-ylmethoxy)piperidine;hydrochloride
SMILESC1COC(COC2CCNCC2)C1.Cl
InChIInChI=1S/C10H19NO2.ClH/c1-2-10(12-7-1)8-13-9-3-5-11-6-4-9;/h9-11H,1-8H2;1H
InChIKeyJECSJGZZQVIHBQ-UHFFFAOYSA-N
MW221.73 g/mol
LogP1.36
Rot. Bonds3

About 4-(oxolan-2-ylmethoxy)piperidine;hydrochloride

4-(oxolan-2-ylmethoxy)piperidine;hydrochloride (PubChem CID 45074945) has the molecular formula C10H20ClNO2 and a molecular weight of 221.73 g/mol. Its IUPAC name is 4-(oxolan-2-ylmethoxy)piperidine;hydrochloride.

Molecular Properties

Compound Name4-(oxolan-2-ylmethoxy)piperidine;hydrochloride
PubChem CID45074945
Molecular FormulaC10H20ClNO2
Molecular Weight221.73 g/mol
Exact Mass221.12
IUPAC Name4-(oxolan-2-ylmethoxy)piperidine;hydrochloride
SMILESC1COC(COC2CCNCC2)C1.Cl
InChIInChI=1S/C10H19NO2.ClH/c1-2-10(12-7-1)8-13-9-3-5-11-6-4-9;/h9-11H,1-8H2;1H
InChIKeyJECSJGZZQVIHBQ-UHFFFAOYSA-N
XLogP1.36
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
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

(3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine
CID 26191909
oxolan-2-ylmethyl 2-piperidin-4-yloxyacetate
CID 63869920
4-(oxolan-2-ylmethoxy)cyclohexan-1-amine
CID 62806705
3-(oxolan-2-ylmethoxy)oxane
CID 71311379
3-(oxolan-2-ylmethoxy)cyclopentan-1-one
CID 79643554
2-(cyclobutyloxymethyl)morpholine
CID 64533662
4-[2-[[(2S)-oxolan-2-yl]methoxy]ethyl]piperidine
CID 26192445
1-[4-(oxan-2-ylmethoxy)piperidin-1-yl]-3-piperidin-4-ylbutan-1-one;hydrochloride
CID 119815515
3-(oxolan-2-ylmethoxy)cyclohexan-1-ol
CID 79618250
3-(oxolan-2-ylmethoxymethyl)pyrrolidine
CID 62372457
3-(oxan-2-ylmethoxy)cyclohexan-1-one
CID 79618470
2-[(3-chlorocyclobutyl)oxymethyl]oxane
CID 66345100

Frequently Asked Questions

What is the IUPAC name of 4-(oxolan-2-ylmethoxy)piperidine;hydrochloride?
The IUPAC name of 4-(oxolan-2-ylmethoxy)piperidine;hydrochloride (CID 45074945) is 4-(oxolan-2-ylmethoxy)piperidine;hydrochloride.
What is the SMILES notation for 4-(oxolan-2-ylmethoxy)piperidine;hydrochloride?
The canonical SMILES for 4-(oxolan-2-ylmethoxy)piperidine;hydrochloride is C1COC(COC2CCNCC2)C1.Cl.
What is the InChIKey of 4-(oxolan-2-ylmethoxy)piperidine;hydrochloride?
The InChIKey is JECSJGZZQVIHBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2.ClH/c1-2-10(12-7-1)8-13-9-3-5-11-6-4-9;/h9-11H,1-8H2;1H.
What are the key properties of 4-(oxolan-2-ylmethoxy)piperidine;hydrochloride?
4-(oxolan-2-ylmethoxy)piperidine;hydrochloride has a molecular weight of 221.73 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxolan-2-ylmethoxy)piperidine;hydrochloride is sourced from PubChem (CID 45074945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).