4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane

C18H30O — CID 144594027

IUPAC4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane
SMILESC.CC.Cc1ccc(C)c2c1CCC21CCOCC1
InChIInChI=1S/C15H20O.C2H6.CH4/c1-11-3-4-12(2)14-13(11)5-6-15(14)7-9-16-10-8-15;1-2;/h3-4H,5-10H2,1-2H3;1-2H3;1H4
InChIKeyMUWDBVISKDATHN-UHFFFAOYSA-N
MW262.44 g/mol
LogP4.96
Rot. Bonds

About 4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane

4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane (PubChem CID 144594027) has the molecular formula C18H30O and a molecular weight of 262.44 g/mol. Its IUPAC name is 4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane.

Molecular Properties

Compound Name4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane
PubChem CID144594027
Molecular FormulaC18H30O
Molecular Weight262.44 g/mol
Exact Mass262.23
IUPAC Name4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane
SMILESC.CC.Cc1ccc(C)c2c1CCC21CCOCC1
InChIInChI=1S/C15H20O.C2H6.CH4/c1-11-3-4-12(2)14-13(11)5-6-15(14)7-9-16-10-8-15;1-2;/h3-4H,5-10H2,1-2H3;1-2H3;1H4
InChIKeyMUWDBVISKDATHN-UHFFFAOYSA-N
XLogP4.96
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.44
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane 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 4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane?
The IUPAC name of 4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane (CID 144594027) is 4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane.
What is the SMILES notation for 4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane?
The canonical SMILES for 4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane is C.CC.Cc1ccc(C)c2c1CCC21CCOCC1.
What is the InChIKey of 4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane?
The InChIKey is MUWDBVISKDATHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O.C2H6.CH4/c1-11-3-4-12(2)14-13(11)5-6-15(14)7-9-16-10-8-15;1-2;/h3-4H,5-10H2,1-2H3;1-2H3;1H4.
What are the key properties of 4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane?
4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane has a molecular weight of 262.44 g/mol, XLogP of 4.96, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dimethylspiro[1,2-dihydroindene-3,4'-oxane];ethane;methane is sourced from PubChem (CID 144594027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).