4-methoxy-1-oxaspiro[4.5]dec-3-ene

C10H16O2 — CID 13300108

IUPAC4-methoxy-1-oxaspiro[4.5]dec-3-ene
SMILESCOC1=CCOC12CCCCC2
InChIInChI=1S/C10H16O2/c1-11-9-5-8-12-10(9)6-3-2-4-7-10/h5H,2-4,6-8H2,1H3
InChIKeyNZRHDNPHUAFODD-UHFFFAOYSA-N
MW168.24 g/mol
LogP2.25
Rot. Bonds1

About 4-methoxy-1-oxaspiro[4.5]dec-3-ene

4-methoxy-1-oxaspiro[4.5]dec-3-ene (PubChem CID 13300108) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is 4-methoxy-1-oxaspiro[4.5]dec-3-ene.

Molecular Properties

Compound Name4-methoxy-1-oxaspiro[4.5]dec-3-ene
PubChem CID13300108
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name4-methoxy-1-oxaspiro[4.5]dec-3-ene
SMILESCOC1=CCOC12CCCCC2
InChIInChI=1S/C10H16O2/c1-11-9-5-8-12-10(9)6-3-2-4-7-10/h5H,2-4,6-8H2,1H3
InChIKeyNZRHDNPHUAFODD-UHFFFAOYSA-N
XLogP2.25
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-Methoxy-1-oxaspiro[4.5]dec-3-en-2-one
CID 581148
4-Ethoxy-1-oxaspiro[4.5]dec-3-en-2-one
CID 13209948
[(2R)-2-methyl-1-oxaspiro[4.5]dec-3-en-4-yl] acetate
CID 13146631
[(2R)-2-pentyl-1-oxaspiro[4.5]dec-3-en-4-yl] acetate
CID 14891633
6-Methoxy-1-oxaspiro[4.5]dec-6-ene
CID 15946867
2-Cyclohexyl-3-methoxy-2,5-dihydrofuran
CID 102055860
(2-cyclohexyl-5,5-dimethyl-2H-furan-3-yl) acetate
CID 102183559
4-[(E)-hex-2-enoxy]-1-oxaspiro[4.5]dec-3-en-2-one
CID 11010380
4-[(E)-pent-2-enoxy]-1-oxaspiro[4.5]dec-3-en-2-one
CID 11064401
1-Oxaspiro[4.5]dec-3-en-4-yl butanoate
CID 69729510
1-Oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate
CID 141445033
2,3-dimethoxy-5-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]cyclohexa-1,3-diene
CID 148693564

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-oxaspiro[4.5]dec-3-ene?
The IUPAC name of 4-methoxy-1-oxaspiro[4.5]dec-3-ene (CID 13300108) is 4-methoxy-1-oxaspiro[4.5]dec-3-ene.
What is the SMILES notation for 4-methoxy-1-oxaspiro[4.5]dec-3-ene?
The canonical SMILES for 4-methoxy-1-oxaspiro[4.5]dec-3-ene is COC1=CCOC12CCCCC2.
What is the InChIKey of 4-methoxy-1-oxaspiro[4.5]dec-3-ene?
The InChIKey is NZRHDNPHUAFODD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-11-9-5-8-12-10(9)6-3-2-4-7-10/h5H,2-4,6-8H2,1H3.
What are the key properties of 4-methoxy-1-oxaspiro[4.5]dec-3-ene?
4-methoxy-1-oxaspiro[4.5]dec-3-ene has a molecular weight of 168.24 g/mol, XLogP of 2.25, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-oxaspiro[4.5]dec-3-ene is sourced from PubChem (CID 13300108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).