7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane

C13H20O2 — CID 129030165

IUPAC7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane
SMILESC1CC2(C1)CC(C1CC13CCCO3)CO2
InChIInChI=1S/C13H20O2/c1-3-12(4-1)7-10(9-15-12)11-8-13(11)5-2-6-14-13/h10-11H,1-9H2
InChIKeyXPESQSDZJAAUOD-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.51
Rot. Bonds1

About 7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane

7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane (PubChem CID 129030165) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is 7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane.

Molecular Properties

Compound Name7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane
PubChem CID129030165
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Name7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane
SMILESC1CC2(C1)CC(C1CC13CCCO3)CO2
InChIInChI=1S/C13H20O2/c1-3-12(4-1)7-10(9-15-12)11-8-13(11)5-2-6-14-13/h10-11H,1-9H2
InChIKeyXPESQSDZJAAUOD-UHFFFAOYSA-N
XLogP2.51
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane with MolForge

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Related Compounds

spiro[oxolane-2,16'-tetracyclo[7.5.2.02,7.010,14]hexadecane]
CID 69253002
(5R,7S)-4,8-dioxadispiro[4.1.47.35]tetradecane
CID 101092010
(5R,8S)-1-oxaspiro[4.4]nonan-8-amine
CID 99996100
(3S,4S)-3-cyclopropyl-5-oxa-2-azaspiro[3.4]octane
CID 124710254
1-oxaspiro[4.5]decan-3-amine
CID 19040159
5-oxaspiro[3.4]octan-7-amine;hydrochloride
CID 122156633
(1S,4S,5S)-spiro[bicyclo[2.2.2]oct-2-ene-5,2'-oxolane]
CID 101097202
3-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidine
CID 104680489
(1S,3'R,4S,7R)-3'-methylspiro[3-oxabicyclo[5.1.0]octane-4,1'-cyclohexane]
CID 125454992
diphosphanyl-[(7R,8S)-8-methyl-1-oxaspiro[4.5]decan-7-yl]-phosphanylphosphane
CID 58714725
spiro[bicyclo[2.2.1]heptane-2,2'-oxolane]
CID 165155234
[(5S,8R)-1-oxaspiro[4.4]nonan-8-yl]methanamine
CID 99996112

Frequently Asked Questions

What is the IUPAC name of 7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane?
The IUPAC name of 7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane (CID 129030165) is 7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane.
What is the SMILES notation for 7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane?
The canonical SMILES for 7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane is C1CC2(C1)CC(C1CC13CCCO3)CO2.
What is the InChIKey of 7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane?
The InChIKey is XPESQSDZJAAUOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2/c1-3-12(4-1)7-10(9-15-12)11-8-13(11)5-2-6-14-13/h10-11H,1-9H2.
What are the key properties of 7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane?
7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane has a molecular weight of 208.30 g/mol, XLogP of 2.51, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-oxaspiro[2.4]heptan-2-yl)-5-oxaspiro[3.4]octane is sourced from PubChem (CID 129030165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).