2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane

C15H24 — CID 527247

IUPAC2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane
SMILESC=C1C2CCC(C)C23CCC(C3)C1(C)C
InChIInChI=1S/C15H24/c1-10-5-6-13-11(2)14(3,4)12-7-8-15(10,13)9-12/h10,12-13H,2,5-9H2,1,3-4H3
InChIKeyVBZRHXLPRWBPEH-UHFFFAOYSA-N
MW204.36 g/mol
LogP4.41
Rot. Bonds

About 2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane

2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane (PubChem CID 527247) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is 2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane.

Molecular Properties

Compound Name2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane
PubChem CID527247
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane
SMILESC=C1C2CCC(C)C23CCC(C3)C1(C)C
InChIInChI=1S/C15H24/c1-10-5-6-13-11(2)14(3,4)12-7-8-15(10,13)9-12/h10,12-13H,2,5-9H2,1,3-4H3
InChIKeyVBZRHXLPRWBPEH-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 2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane?
The IUPAC name of 2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane (CID 527247) is 2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane.
What is the SMILES notation for 2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane?
The canonical SMILES for 2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane is C=C1C2CCC(C)C23CCC(C3)C1(C)C.
What is the InChIKey of 2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane?
The InChIKey is VBZRHXLPRWBPEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24/c1-10-5-6-13-11(2)14(3,4)12-7-8-15(10,13)9-12/h10,12-13H,2,5-9H2,1,3-4H3.
What are the key properties of 2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane?
2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]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 2,7,7-trimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane is sourced from PubChem (CID 527247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).