[1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-2-yl]methanol

C16H29NO2 — CID 102848058

IUPAC[1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-2-yl]methanol
SMILESOCC1CCCCN1CC1CCC2(CCCCC2)O1
InChIInChI=1S/C16H29NO2/c18-13-14-6-2-5-11-17(14)12-15-7-10-16(19-15)8-3-1-4-9-16/h14-15,18H,1-13H2
InChIKeyCTTWOFOTGMAXEW-UHFFFAOYSA-N
MW267.41 g/mol
LogP2.72
Rot. Bonds3

About [1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-2-yl]methanol

[1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-2-yl]methanol (PubChem CID 102848058) has the molecular formula C16H29NO2 and a molecular weight of 267.41 g/mol. Its IUPAC name is [1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-2-yl]methanol
PubChem CID102848058
Molecular FormulaC16H29NO2
Molecular Weight267.41 g/mol
Exact Mass267.22
IUPAC Name[1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-2-yl]methanol
SMILESOCC1CCCCN1CC1CCC2(CCCCC2)O1
InChIInChI=1S/C16H29NO2/c18-13-14-6-2-5-11-17(14)12-15-7-10-16(19-15)8-3-1-4-9-16/h14-15,18H,1-13H2
InChIKeyCTTWOFOTGMAXEW-UHFFFAOYSA-N
XLogP2.72
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.41
LogP ≤ 52.72
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-2-yl]methanol?
The IUPAC name of [1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-2-yl]methanol (CID 102848058) is [1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-2-yl]methanol.
What is the SMILES notation for [1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-2-yl]methanol?
The canonical SMILES for [1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-2-yl]methanol is OCC1CCCCN1CC1CCC2(CCCCC2)O1.
What is the InChIKey of [1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-2-yl]methanol?
The InChIKey is CTTWOFOTGMAXEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29NO2/c18-13-14-6-2-5-11-17(14)12-15-7-10-16(19-15)8-3-1-4-9-16/h14-15,18H,1-13H2.
What are the key properties of [1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-2-yl]methanol?
[1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-2-yl]methanol has a molecular weight of 267.41 g/mol, XLogP of 2.72, 3 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-2-yl]methanol is sourced from PubChem (CID 102848058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).