2-(oxetan-3-yloxymethyl)piperidine

C9H17NO2 — CID 115669762

IUPAC2-(oxetan-3-yloxymethyl)piperidine
SMILESC1CCC(COC2COC2)NC1
InChIInChI=1S/C9H17NO2/c1-2-4-10-8(3-1)5-12-9-6-11-7-9/h8-10H,1-7H2
InChIKeyBCTGMCZERSLCAG-UHFFFAOYSA-N
MW171.24 g/mol
LogP0.54
Rot. Bonds3

About 2-(oxetan-3-yloxymethyl)piperidine

2-(oxetan-3-yloxymethyl)piperidine (PubChem CID 115669762) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is 2-(oxetan-3-yloxymethyl)piperidine.

Molecular Properties

Compound Name2-(oxetan-3-yloxymethyl)piperidine
PubChem CID115669762
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name2-(oxetan-3-yloxymethyl)piperidine
SMILESC1CCC(COC2COC2)NC1
InChIInChI=1S/C9H17NO2/c1-2-4-10-8(3-1)5-12-9-6-11-7-9/h8-10H,1-7H2
InChIKeyBCTGMCZERSLCAG-UHFFFAOYSA-N
XLogP0.54
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(oxan-3-yloxymethyl)piperidine
CID 107135321
2-(cyclohexyloxymethyl)piperidine
CID 24699703
3-(pyrrolidin-2-ylmethoxy)azepan-2-one
CID 106937806
2-(piperidin-2-ylmethoxy)cyclopentan-1-ol
CID 106939405
2-(oxan-4-ylmethoxymethyl)piperidine
CID 62383000
(2S)-2-[(3-methoxycyclohexyl)oxymethyl]pyrrolidine
CID 102820167
2-(2-piperidin-4-yloxyethoxymethyl)piperidine
CID 173320128
2-(ethoxymethyl)azepane
CID 79569846
N-(piperidin-2-ylmethyl)-N-propan-2-yloxetan-3-amine
CID 176601027
2-(oxiran-2-ylmethyl)piperidine
CID 175333700
2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)piperidine
CID 54943160
(2R)-2-(oxolan-3-ylmethoxymethyl)pyrrolidine
CID 102820061

Frequently Asked Questions

What is the IUPAC name of 2-(oxetan-3-yloxymethyl)piperidine?
The IUPAC name of 2-(oxetan-3-yloxymethyl)piperidine (CID 115669762) is 2-(oxetan-3-yloxymethyl)piperidine.
What is the SMILES notation for 2-(oxetan-3-yloxymethyl)piperidine?
The canonical SMILES for 2-(oxetan-3-yloxymethyl)piperidine is C1CCC(COC2COC2)NC1.
What is the InChIKey of 2-(oxetan-3-yloxymethyl)piperidine?
The InChIKey is BCTGMCZERSLCAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c1-2-4-10-8(3-1)5-12-9-6-11-7-9/h8-10H,1-7H2.
What are the key properties of 2-(oxetan-3-yloxymethyl)piperidine?
2-(oxetan-3-yloxymethyl)piperidine has a molecular weight of 171.24 g/mol, XLogP of 0.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxetan-3-yloxymethyl)piperidine is sourced from PubChem (CID 115669762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).