(5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene

C10H14O — CID 101200202

IUPAC(5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene
SMILESCC1=CC[C@@]2(CC=CCO2)C1
InChIInChI=1S/C10H14O/c1-9-4-6-10(8-9)5-2-3-7-11-10/h2-4H,5-8H2,1H3/t10-/m0/s1
InChIKeyZRZIGTGCMRQVIV-JTQLQIEISA-N
MW150.22 g/mol
LogP2.44
Rot. Bonds

About (5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene

(5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene (PubChem CID 101200202) has the molecular formula C10H14O and a molecular weight of 150.22 g/mol. Its IUPAC name is (5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene.

Molecular Properties

Compound Name(5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene
PubChem CID101200202
Molecular FormulaC10H14O
Molecular Weight150.22 g/mol
Exact Mass150.10
IUPAC Name(5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene
SMILESCC1=CC[C@@]2(CC=CCO2)C1
InChIInChI=1S/C10H14O/c1-9-4-6-10(8-9)5-2-3-7-11-10/h2-4H,5-8H2,1H3/t10-/m0/s1
InChIKeyZRZIGTGCMRQVIV-JTQLQIEISA-N
XLogP2.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene?
The IUPAC name of (5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene (CID 101200202) is (5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene.
What is the SMILES notation for (5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene?
The canonical SMILES for (5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene is CC1=CC[C@@]2(CC=CCO2)C1.
What is the InChIKey of (5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene?
The InChIKey is ZRZIGTGCMRQVIV-JTQLQIEISA-N. The full InChI is InChI=1S/C10H14O/c1-9-4-6-10(8-9)5-2-3-7-11-10/h2-4H,5-8H2,1H3/t10-/m0/s1.
What are the key properties of (5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene?
(5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene has a molecular weight of 150.22 g/mol, XLogP of 2.44, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-3-methyl-6-oxaspiro[4.5]deca-2,8-diene is sourced from PubChem (CID 101200202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).