1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine

C15H27NO3 — CID 113414152

IUPAC1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine
SMILESC1CCN(CCOC2CCC3(CC2)OCCO3)CC1
InChIInChI=1S/C15H27NO3/c1-2-8-16(9-3-1)10-11-17-14-4-6-15(7-5-14)18-12-13-19-15/h14H,1-13H2
InChIKeyRUYJBENJIOEFMD-UHFFFAOYSA-N
MW269.38 g/mol
LogP2.17
Rot. Bonds4

About 1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine

1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine (PubChem CID 113414152) has the molecular formula C15H27NO3 and a molecular weight of 269.38 g/mol. Its IUPAC name is 1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine.

Molecular Properties

Compound Name1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine
PubChem CID113414152
Molecular FormulaC15H27NO3
Molecular Weight269.38 g/mol
Exact Mass269.20
IUPAC Name1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine
SMILESC1CCN(CCOC2CCC3(CC2)OCCO3)CC1
InChIInChI=1S/C15H27NO3/c1-2-8-16(9-3-1)10-11-17-14-4-6-15(7-5-14)18-12-13-19-15/h14H,1-13H2
InChIKeyRUYJBENJIOEFMD-UHFFFAOYSA-N
XLogP2.17
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.38
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine?
The IUPAC name of 1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine (CID 113414152) is 1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine.
What is the SMILES notation for 1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine?
The canonical SMILES for 1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine is C1CCN(CCOC2CCC3(CC2)OCCO3)CC1.
What is the InChIKey of 1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine?
The InChIKey is RUYJBENJIOEFMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO3/c1-2-8-16(9-3-1)10-11-17-14-4-6-15(7-5-14)18-12-13-19-15/h14H,1-13H2.
What are the key properties of 1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine?
1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine has a molecular weight of 269.38 g/mol, XLogP of 2.17, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine is sourced from PubChem (CID 113414152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).