1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol

C15H27NO2 — CID 79902312

IUPAC1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol
SMILESCC(O)(C1CCCNC1)C1CCOC2(CCC2)C1
InChIInChI=1S/C15H27NO2/c1-14(17,13-4-2-8-16-11-13)12-5-9-18-15(10-12)6-3-7-15/h12-13,16-17H,2-11H2,1H3
InChIKeyZZWCDDFOQUOZAL-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.09
Rot. Bonds2

About 1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol

1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol (PubChem CID 79902312) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is 1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol.

Molecular Properties

Compound Name1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol
PubChem CID79902312
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol
SMILESCC(O)(C1CCCNC1)C1CCOC2(CCC2)C1
InChIInChI=1S/C15H27NO2/c1-14(17,13-4-2-8-16-11-13)12-5-9-18-15(10-12)6-3-7-15/h12-13,16-17H,2-11H2,1H3
InChIKeyZZWCDDFOQUOZAL-UHFFFAOYSA-N
XLogP2.09
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol?
The IUPAC name of 1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol (CID 79902312) is 1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol.
What is the SMILES notation for 1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol?
The canonical SMILES for 1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol is CC(O)(C1CCCNC1)C1CCOC2(CCC2)C1.
What is the InChIKey of 1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol?
The InChIKey is ZZWCDDFOQUOZAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c1-14(17,13-4-2-8-16-11-13)12-5-9-18-15(10-12)6-3-7-15/h12-13,16-17H,2-11H2,1H3.
What are the key properties of 1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol?
1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol has a molecular weight of 253.39 g/mol, XLogP of 2.09, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-oxaspiro[3.5]nonan-8-yl)-1-piperidin-3-ylethanol is sourced from PubChem (CID 79902312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).