8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane

C15H20O3 — CID 22492982

IUPAC8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane
SMILESCOC1(c2ccccc2)CCC2(CC1)OCCO2
InChIInChI=1S/C15H20O3/c1-16-14(13-5-3-2-4-6-13)7-9-15(10-8-14)17-11-12-18-15/h2-6H,7-12H2,1H3
InChIKeyMGUGJHZIKBJNIV-UHFFFAOYSA-N
MW248.32 g/mol
LogP2.85
Rot. Bonds2

About 8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane

8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane (PubChem CID 22492982) has the molecular formula C15H20O3 and a molecular weight of 248.32 g/mol. Its IUPAC name is 8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane.

Molecular Properties

Compound Name8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane
PubChem CID22492982
Molecular FormulaC15H20O3
Molecular Weight248.32 g/mol
Exact Mass248.14
IUPAC Name8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane
SMILESCOC1(c2ccccc2)CCC2(CC1)OCCO2
InChIInChI=1S/C15H20O3/c1-16-14(13-5-3-2-4-6-13)7-9-15(10-8-14)17-11-12-18-15/h2-6H,7-12H2,1H3
InChIKeyMGUGJHZIKBJNIV-UHFFFAOYSA-N
XLogP2.85
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.32
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane 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 8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane?
The IUPAC name of 8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane (CID 22492982) is 8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane.
What is the SMILES notation for 8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane?
The canonical SMILES for 8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane is COC1(c2ccccc2)CCC2(CC1)OCCO2.
What is the InChIKey of 8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane?
The InChIKey is MGUGJHZIKBJNIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O3/c1-16-14(13-5-3-2-4-6-13)7-9-15(10-8-14)17-11-12-18-15/h2-6H,7-12H2,1H3.
What are the key properties of 8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane?
8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane has a molecular weight of 248.32 g/mol, XLogP of 2.85, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-8-phenyl-1,4-dioxaspiro[4.5]decane is sourced from PubChem (CID 22492982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).