7-methoxy-2-oxaspiro[3.5]nonane

C9H16O2 — CID 90127746

IUPAC7-methoxy-2-oxaspiro[3.5]nonane
SMILESCOC1CCC2(CC1)COC2
InChIInChI=1S/C9H16O2/c1-10-8-2-4-9(5-3-8)6-11-7-9/h8H,2-7H2,1H3
InChIKeyUPNLSDOKRPQUTF-UHFFFAOYSA-N
MW156.22 g/mol
LogP1.59
Rot. Bonds1

About 7-methoxy-2-oxaspiro[3.5]nonane

7-methoxy-2-oxaspiro[3.5]nonane (PubChem CID 90127746) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 7-methoxy-2-oxaspiro[3.5]nonane.

Molecular Properties

Compound Name7-methoxy-2-oxaspiro[3.5]nonane
PubChem CID90127746
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name7-methoxy-2-oxaspiro[3.5]nonane
SMILESCOC1CCC2(CC1)COC2
InChIInChI=1S/C9H16O2/c1-10-8-2-4-9(5-3-8)6-11-7-9/h8H,2-7H2,1H3
InChIKeyUPNLSDOKRPQUTF-UHFFFAOYSA-N
XLogP1.59
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 7-methoxy-2-oxaspiro[3.5]nonane 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 7-methoxy-2-oxaspiro[3.5]nonane?
The IUPAC name of 7-methoxy-2-oxaspiro[3.5]nonane (CID 90127746) is 7-methoxy-2-oxaspiro[3.5]nonane.
What is the SMILES notation for 7-methoxy-2-oxaspiro[3.5]nonane?
The canonical SMILES for 7-methoxy-2-oxaspiro[3.5]nonane is COC1CCC2(CC1)COC2.
What is the InChIKey of 7-methoxy-2-oxaspiro[3.5]nonane?
The InChIKey is UPNLSDOKRPQUTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c1-10-8-2-4-9(5-3-8)6-11-7-9/h8H,2-7H2,1H3.
What are the key properties of 7-methoxy-2-oxaspiro[3.5]nonane?
7-methoxy-2-oxaspiro[3.5]nonane has a molecular weight of 156.22 g/mol, XLogP of 1.59, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2-oxaspiro[3.5]nonane is sourced from PubChem (CID 90127746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).