[1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol

C13H23NO2 — CID 79920344

IUPAC[1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1C1CCOC2(CCC2)C1
InChIInChI=1S/C13H23NO2/c15-10-12-3-1-7-14(12)11-4-8-16-13(9-11)5-2-6-13/h11-12,15H,1-10H2
InChIKeyQNDWXXSAXBHOQH-UHFFFAOYSA-N
MW225.33 g/mol
LogP1.54
Rot. Bonds2

About [1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol

[1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol (PubChem CID 79920344) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is [1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol
PubChem CID79920344
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name[1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1C1CCOC2(CCC2)C1
InChIInChI=1S/C13H23NO2/c15-10-12-3-1-7-14(12)11-4-8-16-13(9-11)5-2-6-13/h11-12,15H,1-10H2
InChIKeyQNDWXXSAXBHOQH-UHFFFAOYSA-N
XLogP1.54
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol?
The IUPAC name of [1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol (CID 79920344) is [1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol is OCC1CCCN1C1CCOC2(CCC2)C1.
What is the InChIKey of [1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol?
The InChIKey is QNDWXXSAXBHOQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c15-10-12-3-1-7-14(12)11-4-8-16-13(9-11)5-2-6-13/h11-12,15H,1-10H2.
What are the key properties of [1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol?
[1-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidin-2-yl]methanol has a molecular weight of 225.33 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 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)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 79920344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).