5-ethenyl-5-methyl-1-oxaspiro[2.5]octane

C10H16O — CID 14891181

IUPAC5-ethenyl-5-methyl-1-oxaspiro[2.5]octane
SMILESC=CC1(C)CCCC2(CO2)C1
InChIInChI=1S/C10H16O/c1-3-9(2)5-4-6-10(7-9)8-11-10/h3H,1,4-8H2,2H3
InChIKeyOLROTQDHDXDWRG-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.52
Rot. Bonds1

About 5-ethenyl-5-methyl-1-oxaspiro[2.5]octane

5-ethenyl-5-methyl-1-oxaspiro[2.5]octane (PubChem CID 14891181) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 5-ethenyl-5-methyl-1-oxaspiro[2.5]octane.

Molecular Properties

Compound Name5-ethenyl-5-methyl-1-oxaspiro[2.5]octane
PubChem CID14891181
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name5-ethenyl-5-methyl-1-oxaspiro[2.5]octane
SMILESC=CC1(C)CCCC2(CO2)C1
InChIInChI=1S/C10H16O/c1-3-9(2)5-4-6-10(7-9)8-11-10/h3H,1,4-8H2,2H3
InChIKeyOLROTQDHDXDWRG-UHFFFAOYSA-N
XLogP2.52
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3R,4S)-5,5-dimethyl-4-prop-2-enyl-1-oxaspiro[2.5]octane
CID 102038580
5,5-Dimethyl-4-methylidene-1-oxaspiro[2.5]octane
CID 15006651
4-Ethenyl-1,4-dimethyl-7-oxabicyclo[4.1.0]heptane
CID 22137175
2-Methyl-2-(2,2,4,4-tetramethylhept-6-enyl)oxirane
CID 22712633
2-Methyl-2-(2,2,4,4-tetramethylhex-5-enyl)oxirane
CID 22712639
2-(4-Ethenyl-4-methyl-3-prop-1-en-2-ylcyclohexyl)-2-methyloxirane
CID 85922606
2-(2,2,4,4-Tetramethylhex-5-enyl)oxirane
CID 121263342
2-(4-Ethyl-2,4-dimethylhex-5-en-2-yl)oxirane
CID 123224212
(3R,7S)-7-ethenyl-5,5-dimethyl-1-oxaspiro[2.5]octane
CID 144849124
1,5-Dimethyl-2-oxabicyclo[3.3.1]non-3-ene
CID 71381574
(3R,4R)-4-but-3-enyl-5,5-dimethyl-1-oxaspiro[2.5]octane
CID 100923257

Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-5-methyl-1-oxaspiro[2.5]octane?
The IUPAC name of 5-ethenyl-5-methyl-1-oxaspiro[2.5]octane (CID 14891181) is 5-ethenyl-5-methyl-1-oxaspiro[2.5]octane.
What is the SMILES notation for 5-ethenyl-5-methyl-1-oxaspiro[2.5]octane?
The canonical SMILES for 5-ethenyl-5-methyl-1-oxaspiro[2.5]octane is C=CC1(C)CCCC2(CO2)C1.
What is the InChIKey of 5-ethenyl-5-methyl-1-oxaspiro[2.5]octane?
The InChIKey is OLROTQDHDXDWRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-3-9(2)5-4-6-10(7-9)8-11-10/h3H,1,4-8H2,2H3.
What are the key properties of 5-ethenyl-5-methyl-1-oxaspiro[2.5]octane?
5-ethenyl-5-methyl-1-oxaspiro[2.5]octane has a molecular weight of 152.24 g/mol, XLogP of 2.52, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-5-methyl-1-oxaspiro[2.5]octane is sourced from PubChem (CID 14891181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).