1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine

C13H27NO2 — CID 166567443

IUPAC1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine
SMILESCCOCCN1CCC(OC(C)(C)C)CC1
InChIInChI=1S/C13H27NO2/c1-5-15-11-10-14-8-6-12(7-9-14)16-13(2,3)4/h12H,5-11H2,1-4H3
InChIKeyFQGPIXHHYPYWIU-UHFFFAOYSA-N
MW229.36 g/mol
LogP2.30
Rot. Bonds5

About 1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine

1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine (PubChem CID 166567443) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is 1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine.

Molecular Properties

Compound Name1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine
PubChem CID166567443
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC Name1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine
SMILESCCOCCN1CCC(OC(C)(C)C)CC1
InChIInChI=1S/C13H27NO2/c1-5-15-11-10-14-8-6-12(7-9-14)16-13(2,3)4/h12H,5-11H2,1-4H3
InChIKeyFQGPIXHHYPYWIU-UHFFFAOYSA-N
XLogP2.30
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.36
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-Pentylmorpholine
CID 200930
1-(2-Methoxyethyl)piperidin-4-ol
CID 21353752
1-[2-(Propan-2-yloxy)ethyl]piperidin-4-ol
CID 57637276
1-(2-Ethoxyethyl)piperidine
CID 22622871
1-(2-Methoxypropyl)piperidine
CID 23189147
3-(Tert-butoxy)-1-piperidylpropan-2-ol
CID 16456248
2,2-Dimethyl-4-(oxan-2-ylmethyl)morpholine
CID 53514669
3-Pentyn-2-ol, 2-methyl-5-(2-piperidinoethoxy)-
CID 140095
[4-(Diethylamino)-1-morpholin-4-ylbutan-2-yl] hypofluorite
CID 22172826
1-(3-Fluoropropyl)-4-[(2-methylpropan-2-yl)oxy]piperidine
CID 58364950
1-Ethyl-3-fluoro-4-[(2-methylpropan-2-yl)oxy]piperidine
CID 117970577
1-(2-Fluoroethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine
CID 118688852

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine?
The IUPAC name of 1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine (CID 166567443) is 1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine.
What is the SMILES notation for 1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine?
The canonical SMILES for 1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine is CCOCCN1CCC(OC(C)(C)C)CC1.
What is the InChIKey of 1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine?
The InChIKey is FQGPIXHHYPYWIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2/c1-5-15-11-10-14-8-6-12(7-9-14)16-13(2,3)4/h12H,5-11H2,1-4H3.
What are the key properties of 1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine?
1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine has a molecular weight of 229.36 g/mol, XLogP of 2.30, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyethyl)-4-[(2-methylpropan-2-yl)oxy]piperidine is sourced from PubChem (CID 166567443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).