6-methoxy-6-methylspiro[2.5]octane

C10H18O — CID 142332928

IUPAC6-methoxy-6-methylspiro[2.5]octane
SMILESCOC1(C)CCC2(CC2)CC1
InChIInChI=1S/C10H18O/c1-9(11-2)3-5-10(6-4-9)7-8-10/h3-8H2,1-2H3
InChIKeyYMQYZDSVEUZSFH-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.75
Rot. Bonds1

About 6-methoxy-6-methylspiro[2.5]octane

6-methoxy-6-methylspiro[2.5]octane (PubChem CID 142332928) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 6-methoxy-6-methylspiro[2.5]octane.

Molecular Properties

Compound Name6-methoxy-6-methylspiro[2.5]octane
PubChem CID142332928
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name6-methoxy-6-methylspiro[2.5]octane
SMILESCOC1(C)CCC2(CC2)CC1
InChIInChI=1S/C10H18O/c1-9(11-2)3-5-10(6-4-9)7-8-10/h3-8H2,1-2H3
InChIKeyYMQYZDSVEUZSFH-UHFFFAOYSA-N
XLogP2.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-Methoxy-4-methylbicyclo(2.2.2)octane
CID 23049
6,6-Dimethyl-1-oxaspiro[2.5]octane
CID 64400563
4-Tert-butyl-1-methoxy-1-methylcyclohexane
CID 12716143
4-Tert-butyl-1-ethyl-1-methoxycyclohexane
CID 16083419
1-(2,2-Dimethylpropyl)-1-methoxy-4-propan-2-ylcyclohexane
CID 21025543
1-Ethyl-4-methoxy-1-methylcyclohexane
CID 21061080
4-(2,2-Dimethylpropyl)-1-methoxy-1-methylcyclohexane
CID 58938764
1-(2,2-Dimethylpropyl)-1-methoxy-4-methylcyclohexane
CID 59186623
1-(2,2-Dimethylpropyl)-1-methoxycyclohexane
CID 59443524
6-Methylspiro[2.5]octan-6-ol
CID 59845725
1-Methoxy-1-methyl-4-propylcyclohexane
CID 68285105
1-(2-Ethylbutyl)-1-methoxy-4-methylcyclohexane
CID 71050907

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-6-methylspiro[2.5]octane?
The IUPAC name of 6-methoxy-6-methylspiro[2.5]octane (CID 142332928) is 6-methoxy-6-methylspiro[2.5]octane.
What is the SMILES notation for 6-methoxy-6-methylspiro[2.5]octane?
The canonical SMILES for 6-methoxy-6-methylspiro[2.5]octane is COC1(C)CCC2(CC2)CC1.
What is the InChIKey of 6-methoxy-6-methylspiro[2.5]octane?
The InChIKey is YMQYZDSVEUZSFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-9(11-2)3-5-10(6-4-9)7-8-10/h3-8H2,1-2H3.
What are the key properties of 6-methoxy-6-methylspiro[2.5]octane?
6-methoxy-6-methylspiro[2.5]octane has a molecular weight of 154.25 g/mol, XLogP of 2.75, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-6-methylspiro[2.5]octane is sourced from PubChem (CID 142332928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).