6-ethoxy-6-methoxyspiro[2.5]octane

C11H20O2 — CID 144535072

IUPAC6-ethoxy-6-methoxyspiro[2.5]octane
SMILESCCOC1(OC)CCC2(CC2)CC1
InChIInChI=1S/C11H20O2/c1-3-13-11(12-2)8-6-10(4-5-10)7-9-11/h3-9H2,1-2H3
InChIKeyPYOUQJOWCQBQES-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.72
Rot. Bonds3

About 6-ethoxy-6-methoxyspiro[2.5]octane

6-ethoxy-6-methoxyspiro[2.5]octane (PubChem CID 144535072) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 6-ethoxy-6-methoxyspiro[2.5]octane.

Molecular Properties

Compound Name6-ethoxy-6-methoxyspiro[2.5]octane
PubChem CID144535072
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name6-ethoxy-6-methoxyspiro[2.5]octane
SMILESCCOC1(OC)CCC2(CC2)CC1
InChIInChI=1S/C11H20O2/c1-3-13-11(12-2)8-6-10(4-5-10)7-9-11/h3-9H2,1-2H3
InChIKeyPYOUQJOWCQBQES-UHFFFAOYSA-N
XLogP2.72
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 6-ethoxy-6-methoxyspiro[2.5]octane 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

4-tert-Butylcyclohexanone diethyl acetal
CID 137253
8,8-Dimethyl-1,4-dioxaspiro[4.5]decane
CID 57602903
2,2,6,6,9,9-Hexamethyl-1,3-dioxacycloundecane
CID 134986699
3-(1,1-Diethoxyethyl)-1,1-dimethylcyclohexane
CID 14817848
1,1-Diethoxy-4-ethylcyclohexane
CID 45093892
7,10-Dioxadispiro[2.2.4.2]dodecane
CID 57336622
4-(Methoxymethoxy)-1,1-dimethylcyclohexane
CID 57602827
8-Ethyl-8-methyl-1,4-dioxaspiro[4.5]decane
CID 58388230
Tert-butyl spiro[2.5]octan-6-yl carbonate
CID 68856404
8-(Cyclopropylmethyl)-8-methyl-1,4-dioxaspiro[4.5]decane
CID 69192921
1,1-Bis(4,4-dimethylnonan-5-yloxy)cyclohexane
CID 89789948
7,11-Dioxadispiro[2.2.56.23]tridecane
CID 90070233

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-6-methoxyspiro[2.5]octane?
The IUPAC name of 6-ethoxy-6-methoxyspiro[2.5]octane (CID 144535072) is 6-ethoxy-6-methoxyspiro[2.5]octane.
What is the SMILES notation for 6-ethoxy-6-methoxyspiro[2.5]octane?
The canonical SMILES for 6-ethoxy-6-methoxyspiro[2.5]octane is CCOC1(OC)CCC2(CC2)CC1.
What is the InChIKey of 6-ethoxy-6-methoxyspiro[2.5]octane?
The InChIKey is PYOUQJOWCQBQES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-13-11(12-2)8-6-10(4-5-10)7-9-11/h3-9H2,1-2H3.
What are the key properties of 6-ethoxy-6-methoxyspiro[2.5]octane?
6-ethoxy-6-methoxyspiro[2.5]octane has a molecular weight of 184.28 g/mol, XLogP of 2.72, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-6-methoxyspiro[2.5]octane is sourced from PubChem (CID 144535072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).