6,6-dimethylbicyclo[3.2.1]octane

C10H18 — CID 154531364

IUPAC6,6-dimethylbicyclo[3.2.1]octane
SMILESCC1(C)CC2CCCC1C2
InChIInChI=1S/C10H18/c1-10(2)7-8-4-3-5-9(10)6-8/h8-9H,3-7H2,1-2H3
InChIKeyVOMPJEYRKBAMCW-UHFFFAOYSA-N
MW138.25 g/mol
LogP3.22
Rot. Bonds

About 6,6-dimethylbicyclo[3.2.1]octane

6,6-dimethylbicyclo[3.2.1]octane (PubChem CID 154531364) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is 6,6-dimethylbicyclo[3.2.1]octane.

Molecular Properties

Compound Name6,6-dimethylbicyclo[3.2.1]octane
PubChem CID154531364
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Name6,6-dimethylbicyclo[3.2.1]octane
SMILESCC1(C)CC2CCCC1C2
InChIInChI=1S/C10H18/c1-10(2)7-8-4-3-5-9(10)6-8/h8-9H,3-7H2,1-2H3
InChIKeyVOMPJEYRKBAMCW-UHFFFAOYSA-N
XLogP3.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.25
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 6,6-dimethylbicyclo[3.2.1]octane?
The IUPAC name of 6,6-dimethylbicyclo[3.2.1]octane (CID 154531364) is 6,6-dimethylbicyclo[3.2.1]octane.
What is the SMILES notation for 6,6-dimethylbicyclo[3.2.1]octane?
The canonical SMILES for 6,6-dimethylbicyclo[3.2.1]octane is CC1(C)CC2CCCC1C2.
What is the InChIKey of 6,6-dimethylbicyclo[3.2.1]octane?
The InChIKey is VOMPJEYRKBAMCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18/c1-10(2)7-8-4-3-5-9(10)6-8/h8-9H,3-7H2,1-2H3.
What are the key properties of 6,6-dimethylbicyclo[3.2.1]octane?
6,6-dimethylbicyclo[3.2.1]octane has a molecular weight of 138.25 g/mol, XLogP of 3.22, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethylbicyclo[3.2.1]octane is sourced from PubChem (CID 154531364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).