1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol

C15H27NO2 — CID 102848054

IUPAC1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol
SMILESOC1CCN(CC2CCC3(CCCCC3)O2)CC1
InChIInChI=1S/C15H27NO2/c17-13-5-10-16(11-6-13)12-14-4-9-15(18-14)7-2-1-3-8-15/h13-14,17H,1-12H2
InChIKeyUSEMJPHTOYZVIH-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.33
Rot. Bonds2

About 1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol

1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol (PubChem CID 102848054) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is 1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol.

Molecular Properties

Compound Name1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol
PubChem CID102848054
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol
SMILESOC1CCN(CC2CCC3(CCCCC3)O2)CC1
InChIInChI=1S/C15H27NO2/c17-13-5-10-16(11-6-13)12-14-4-9-15(18-14)7-2-1-3-8-15/h13-14,17H,1-12H2
InChIKeyUSEMJPHTOYZVIH-UHFFFAOYSA-N
XLogP2.33
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol?
The IUPAC name of 1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol (CID 102848054) is 1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol.
What is the SMILES notation for 1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol?
The canonical SMILES for 1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol is OC1CCN(CC2CCC3(CCCCC3)O2)CC1.
What is the InChIKey of 1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol?
The InChIKey is USEMJPHTOYZVIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c17-13-5-10-16(11-6-13)12-14-4-9-15(18-14)7-2-1-3-8-15/h13-14,17H,1-12H2.
What are the key properties of 1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol?
1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol has a molecular weight of 253.39 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-4-ol is sourced from PubChem (CID 102848054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).