4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine

C13H25NO2 — CID 58873378

IUPAC4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine
SMILESCC(C)N1CCC(OCC2(C)COC2)CC1
InChIInChI=1S/C13H25NO2/c1-11(2)14-6-4-12(5-7-14)16-10-13(3)8-15-9-13/h11-12H,4-10H2,1-3H3
InChIKeyGLQDBDHSDQIFLT-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.91
Rot. Bonds4

About 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine

4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine (PubChem CID 58873378) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine.

Molecular Properties

Compound Name4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine
PubChem CID58873378
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine
SMILESCC(C)N1CCC(OCC2(C)COC2)CC1
InChIInChI=1S/C13H25NO2/c1-11(2)14-6-4-12(5-7-14)16-10-13(3)8-15-9-13/h11-12H,4-10H2,1-3H3
InChIKeyGLQDBDHSDQIFLT-UHFFFAOYSA-N
XLogP1.91
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-Methoxypropoxy)-1-methylpiperidine
CID 57067284
4-[(2-Methylpropan-2-yl)oxy]-1-propan-2-ylpiperidine
CID 57698822
4-Ethoxy-1-propan-2-ylpiperidine
CID 58110291
4-[(2-Methylpropan-2-yl)oxy]-1-(oxetan-3-yl)piperidine
CID 58364939
1-Propan-2-yl-4-propoxypiperidine
CID 58546888
4-(2-Methylpropoxy)-1-propan-2-ylpiperidine
CID 58547159
1-Propan-2-yl-4-propan-2-yloxypiperidine
CID 58873670
1-Methyl-4-[(3-methyloxetan-3-yl)methoxy]piperidine
CID 89360335
4-Methoxy-1-(oxetan-3-yl)piperidine
CID 90176060
4-Ethoxy-1-(oxetan-3-yl)piperidine
CID 90227732
4-(2-Methoxyethoxy)-1-propan-2-ylpiperidine
CID 117618972
N,1-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine
CID 118534926

Frequently Asked Questions

What is the IUPAC name of 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine?
The IUPAC name of 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine (CID 58873378) is 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine.
What is the SMILES notation for 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine?
The canonical SMILES for 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine is CC(C)N1CCC(OCC2(C)COC2)CC1.
What is the InChIKey of 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine?
The InChIKey is GLQDBDHSDQIFLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-11(2)14-6-4-12(5-7-14)16-10-13(3)8-15-9-13/h11-12H,4-10H2,1-3H3.
What are the key properties of 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine?
4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine has a molecular weight of 227.35 g/mol, XLogP of 1.91, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine is sourced from PubChem (CID 58873378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).