5-oxaspiro[3.5]nonan-6-ylmethanol

C9H16O2 — CID 130584302

IUPAC5-oxaspiro[3.5]nonan-6-ylmethanol
SMILESOCC1CCCC2(CCC2)O1
InChIInChI=1S/C9H16O2/c10-7-8-3-1-4-9(11-8)5-2-6-9/h8,10H,1-7H2
InChIKeyLQEXKIDWTNTFGC-UHFFFAOYSA-N
MW156.22 g/mol
LogP1.47
Rot. Bonds1

About 5-oxaspiro[3.5]nonan-6-ylmethanol

5-oxaspiro[3.5]nonan-6-ylmethanol (PubChem CID 130584302) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 5-oxaspiro[3.5]nonan-6-ylmethanol.

Molecular Properties

Compound Name5-oxaspiro[3.5]nonan-6-ylmethanol
PubChem CID130584302
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name5-oxaspiro[3.5]nonan-6-ylmethanol
SMILESOCC1CCCC2(CCC2)O1
InChIInChI=1S/C9H16O2/c10-7-8-3-1-4-9(11-8)5-2-6-9/h8,10H,1-7H2
InChIKeyLQEXKIDWTNTFGC-UHFFFAOYSA-N
XLogP1.47
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-oxaspiro[3.5]nonan-6-ylmethanol 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 5-oxaspiro[3.5]nonan-6-ylmethanol?
The IUPAC name of 5-oxaspiro[3.5]nonan-6-ylmethanol (CID 130584302) is 5-oxaspiro[3.5]nonan-6-ylmethanol.
What is the SMILES notation for 5-oxaspiro[3.5]nonan-6-ylmethanol?
The canonical SMILES for 5-oxaspiro[3.5]nonan-6-ylmethanol is OCC1CCCC2(CCC2)O1.
What is the InChIKey of 5-oxaspiro[3.5]nonan-6-ylmethanol?
The InChIKey is LQEXKIDWTNTFGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c10-7-8-3-1-4-9(11-8)5-2-6-9/h8,10H,1-7H2.
What are the key properties of 5-oxaspiro[3.5]nonan-6-ylmethanol?
5-oxaspiro[3.5]nonan-6-ylmethanol has a molecular weight of 156.22 g/mol, XLogP of 1.47, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxaspiro[3.5]nonan-6-ylmethanol is sourced from PubChem (CID 130584302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).