2,6-dimethylbicyclo[3.2.1]octane

C10H18 — CID 557178

IUPAC2,6-dimethylbicyclo[3.2.1]octane
SMILESCC1CC2CC1CCC2C
InChIInChI=1S/C10H18/c1-7-3-4-9-6-10(7)5-8(9)2/h7-10H,3-6H2,1-2H3
InChIKeyDRLUAQMFPMRPMU-UHFFFAOYSA-N
MW138.25 g/mol
LogP3.08
Rot. Bonds

About 2,6-dimethylbicyclo[3.2.1]octane

2,6-dimethylbicyclo[3.2.1]octane (PubChem CID 557178) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is 2,6-dimethylbicyclo[3.2.1]octane.

Molecular Properties

Compound Name2,6-dimethylbicyclo[3.2.1]octane
PubChem CID557178
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Name2,6-dimethylbicyclo[3.2.1]octane
SMILESCC1CC2CC1CCC2C
InChIInChI=1S/C10H18/c1-7-3-4-9-6-10(7)5-8(9)2/h7-10H,3-6H2,1-2H3
InChIKeyDRLUAQMFPMRPMU-UHFFFAOYSA-N
XLogP3.08
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 ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethylbicyclo[3.2.1]octane?
The IUPAC name of 2,6-dimethylbicyclo[3.2.1]octane (CID 557178) is 2,6-dimethylbicyclo[3.2.1]octane.
What is the SMILES notation for 2,6-dimethylbicyclo[3.2.1]octane?
The canonical SMILES for 2,6-dimethylbicyclo[3.2.1]octane is CC1CC2CC1CCC2C.
What is the InChIKey of 2,6-dimethylbicyclo[3.2.1]octane?
The InChIKey is DRLUAQMFPMRPMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18/c1-7-3-4-9-6-10(7)5-8(9)2/h7-10H,3-6H2,1-2H3.
What are the key properties of 2,6-dimethylbicyclo[3.2.1]octane?
2,6-dimethylbicyclo[3.2.1]octane has a molecular weight of 138.25 g/mol, XLogP of 3.08, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethylbicyclo[3.2.1]octane is sourced from PubChem (CID 557178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).