1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene

C12H20O2 — CID 66608614

IUPAC1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene
SMILESCOC1OCCC12CCC(C)=CC2C
InChIInChI=1S/C12H20O2/c1-9-4-5-12(10(2)8-9)6-7-14-11(12)13-3/h8,10-11H,4-7H2,1-3H3
InChIKeyNFGZFDHJWYYLAS-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.74
Rot. Bonds1

About 1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene

1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene (PubChem CID 66608614) has the molecular formula C12H20O2 and a molecular weight of 196.29 g/mol. Its IUPAC name is 1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene.

Molecular Properties

Compound Name1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene
PubChem CID66608614
Molecular FormulaC12H20O2
Molecular Weight196.29 g/mol
Exact Mass196.15
IUPAC Name1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene
SMILESCOC1OCCC12CCC(C)=CC2C
InChIInChI=1S/C12H20O2/c1-9-4-5-12(10(2)8-9)6-7-14-11(12)13-3/h8,10-11H,4-7H2,1-3H3
InChIKeyNFGZFDHJWYYLAS-UHFFFAOYSA-N
XLogP2.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene with MolForge

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

Launch Full Analysis

Related Compounds

1,3-Dioxane, 2-(2,4-dimethyl-3-cyclohexen-1-yl)-5-methyl-5-(1-methylpropyl)-
CID 16070752
2,4-Dioxaspiro(5.5)undec-8-ene, 3-ethyl-8,11(or 9,11)-dimethyl-
CID 172844
1-Methoxy-7,9-dimethyl-2-oxaspiro[5.5]undec-8-ene
CID 66600706
5-Sec-butyl-2-(4,6-dimethylcyclohex-3-en-1-yl)-5-methyl-1,3-dioxane
CID 139415167
4,5-Dimethyl-2-(2,4,6-trimethylcyclohex-3-en-1-yl)-1,3-dioxolane
CID 3115170
Cyclohexene, 4-(dimethoxymethyl)-1,3-dimethyl-
CID 21156084
1,3-Dioxane, 2-[(1R,2R)-2,4-dimethyl-3-cyclohexen1-yl]-5-methyl-5-(1-methylpropyl)-, cis-
CID 165363669
1,3-Dioxane, 2-[(1S,2S)-2,4-dimethyl-3-cyclohexen1-yl]-5-methyl-5-(1-methylpropyl)-, cis-
CID 165363673
1,3-Dioxane, 2-[(1S,2R)-2,4-dimethyl-3-cyclohexen1-yl]-5-methyl-5-(1-methylpropyl)-, cis-
CID 165363674
1,3-Dioxane, 2-[(1R,2S)-2,4-dimethyl-3-cyclohexen1-yl]-5-methyl-5-(1-methylpropyl)-, cis-
CID 165363675
3-Isopropyl-9-methyl-2,4-dioxaspiro[5.5]undec-8-ene
CID 764102
5-Methyl-2-(2,4,6-trimethylcyclohex-3-en-1-yl)-1,3-dioxane
CID 3115171

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene?
The IUPAC name of 1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene (CID 66608614) is 1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene.
What is the SMILES notation for 1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene?
The canonical SMILES for 1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene is COC1OCCC12CCC(C)=CC2C.
What is the InChIKey of 1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene?
The InChIKey is NFGZFDHJWYYLAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O2/c1-9-4-5-12(10(2)8-9)6-7-14-11(12)13-3/h8,10-11H,4-7H2,1-3H3.
What are the key properties of 1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene?
1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene has a molecular weight of 196.29 g/mol, XLogP of 2.74, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-6,8-dimethyl-2-oxaspiro[4.5]dec-7-ene is sourced from PubChem (CID 66608614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).