2,6-dimethylidenebicyclo[3.3.2]decane

C12H18 — CID 85381418

IUPAC2,6-dimethylidenebicyclo[3.3.2]decane
SMILESC=C1CCC2CCC1CCC2=C
InChIInChI=1S/C12H18/c1-9-3-5-12-8-7-11(9)6-4-10(12)2/h11-12H,1-8H2
InChIKeyUZTQQILWXFHTLT-UHFFFAOYSA-N
MW162.28 g/mol
LogP3.70
Rot. Bonds

About 2,6-dimethylidenebicyclo[3.3.2]decane

2,6-dimethylidenebicyclo[3.3.2]decane (PubChem CID 85381418) has the molecular formula C12H18 and a molecular weight of 162.28 g/mol. Its IUPAC name is 2,6-dimethylidenebicyclo[3.3.2]decane.

Molecular Properties

Compound Name2,6-dimethylidenebicyclo[3.3.2]decane
PubChem CID85381418
Molecular FormulaC12H18
Molecular Weight162.28 g/mol
Exact Mass162.14
IUPAC Name2,6-dimethylidenebicyclo[3.3.2]decane
SMILESC=C1CCC2CCC1CCC2=C
InChIInChI=1S/C12H18/c1-9-3-5-12-8-7-11(9)6-4-10(12)2/h11-12H,1-8H2
InChIKeyUZTQQILWXFHTLT-UHFFFAOYSA-N
XLogP3.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.28
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethylidenebicyclo[3.3.2]decane?
The IUPAC name of 2,6-dimethylidenebicyclo[3.3.2]decane (CID 85381418) is 2,6-dimethylidenebicyclo[3.3.2]decane.
What is the SMILES notation for 2,6-dimethylidenebicyclo[3.3.2]decane?
The canonical SMILES for 2,6-dimethylidenebicyclo[3.3.2]decane is C=C1CCC2CCC1CCC2=C.
What is the InChIKey of 2,6-dimethylidenebicyclo[3.3.2]decane?
The InChIKey is UZTQQILWXFHTLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18/c1-9-3-5-12-8-7-11(9)6-4-10(12)2/h11-12H,1-8H2.
What are the key properties of 2,6-dimethylidenebicyclo[3.3.2]decane?
2,6-dimethylidenebicyclo[3.3.2]decane has a molecular weight of 162.28 g/mol, XLogP of 3.70, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethylidenebicyclo[3.3.2]decane is sourced from PubChem (CID 85381418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).