2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane

C15H24 — CID 25203064

IUPAC2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane
SMILESC=C1CCC2C3C1C2(C)CCCC3(C)C
InChIInChI=1S/C15H24/c1-10-6-7-11-13-12(10)15(11,4)9-5-8-14(13,2)3/h11-13H,1,5-9H2,2-4H3
InChIKeyDQOVXHMHLOWECL-UHFFFAOYSA-N
MW204.36 g/mol
LogP4.41
Rot. Bonds

About 2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane

2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane (PubChem CID 25203064) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is 2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane.

Molecular Properties

Compound Name2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane
PubChem CID25203064
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane
SMILESC=C1CCC2C3C1C2(C)CCCC3(C)C
InChIInChI=1S/C15H24/c1-10-6-7-11-13-12(10)15(11,4)9-5-8-14(13,2)3/h11-13H,1,5-9H2,2-4H3
InChIKeyDQOVXHMHLOWECL-UHFFFAOYSA-N
XLogP4.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 54.41
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 2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane?
The IUPAC name of 2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane (CID 25203064) is 2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane.
What is the SMILES notation for 2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane?
The canonical SMILES for 2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane is C=C1CCC2C3C1C2(C)CCCC3(C)C.
What is the InChIKey of 2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane?
The InChIKey is DQOVXHMHLOWECL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24/c1-10-6-7-11-13-12(10)15(11,4)9-5-8-14(13,2)3/h11-13H,1,5-9H2,2-4H3.
What are the key properties of 2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane?
2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane has a molecular weight of 204.36 g/mol, XLogP of 4.41, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,6-trimethyl-9-methylidenetricyclo[5.4.0.02,8]undecane is sourced from PubChem (CID 25203064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).