2-methylidene-1-oxaspiro[4.4]nonane

C9H14O — CID 14560573

IUPAC2-methylidene-1-oxaspiro[4.4]nonane
SMILESC=C1CCC2(CCCC2)O1
InChIInChI=1S/C9H14O/c1-8-4-7-9(10-8)5-2-3-6-9/h1-7H2
InChIKeyDUNXKHWUSSYDMO-UHFFFAOYSA-N
MW138.21 g/mol
LogP2.62
Rot. Bonds

About 2-methylidene-1-oxaspiro[4.4]nonane

2-methylidene-1-oxaspiro[4.4]nonane (PubChem CID 14560573) has the molecular formula C9H14O and a molecular weight of 138.21 g/mol. Its IUPAC name is 2-methylidene-1-oxaspiro[4.4]nonane.

Molecular Properties

Compound Name2-methylidene-1-oxaspiro[4.4]nonane
PubChem CID14560573
Molecular FormulaC9H14O
Molecular Weight138.21 g/mol
Exact Mass138.10
IUPAC Name2-methylidene-1-oxaspiro[4.4]nonane
SMILESC=C1CCC2(CCCC2)O1
InChIInChI=1S/C9H14O/c1-8-4-7-9(10-8)5-2-3-6-9/h1-7H2
InChIKeyDUNXKHWUSSYDMO-UHFFFAOYSA-N
XLogP2.62
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methylidene-1-oxaspiro[4.4]nonane?
The IUPAC name of 2-methylidene-1-oxaspiro[4.4]nonane (CID 14560573) is 2-methylidene-1-oxaspiro[4.4]nonane.
What is the SMILES notation for 2-methylidene-1-oxaspiro[4.4]nonane?
The canonical SMILES for 2-methylidene-1-oxaspiro[4.4]nonane is C=C1CCC2(CCCC2)O1.
What is the InChIKey of 2-methylidene-1-oxaspiro[4.4]nonane?
The InChIKey is DUNXKHWUSSYDMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O/c1-8-4-7-9(10-8)5-2-3-6-9/h1-7H2.
What are the key properties of 2-methylidene-1-oxaspiro[4.4]nonane?
2-methylidene-1-oxaspiro[4.4]nonane has a molecular weight of 138.21 g/mol, XLogP of 2.62, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidene-1-oxaspiro[4.4]nonane is sourced from PubChem (CID 14560573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).