(1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane

C15H24 — CID 91750164

IUPAC(1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane
SMILESC=C1C[C@@]23CC[C@@H]1C(C)(C)[C@@H]2CC[C@H]3C
InChIInChI=1S/C15H24/c1-10-9-15-8-7-12(10)14(3,4)13(15)6-5-11(15)2/h11-13H,1,5-9H2,2-4H3/t11-,12+,13+,15-/m1/s1
InChIKeySODGFMASLAAZRW-UKTARXLSSA-N
MW204.36 g/mol
LogP4.41
Rot. Bonds

About (1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane

(1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane (PubChem CID 91750164) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is (1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane.

Molecular Properties

Compound Name(1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane
PubChem CID91750164
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name(1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane
SMILESC=C1C[C@@]23CC[C@@H]1C(C)(C)[C@@H]2CC[C@H]3C
InChIInChI=1S/C15H24/c1-10-9-15-8-7-12(10)14(3,4)13(15)6-5-11(15)2/h11-13H,1,5-9H2,2-4H3/t11-,12+,13+,15-/m1/s1
InChIKeySODGFMASLAAZRW-UKTARXLSSA-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'}

Analyze (1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane?
The IUPAC name of (1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane (CID 91750164) is (1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane.
What is the SMILES notation for (1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane?
The canonical SMILES for (1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane is C=C1C[C@@]23CC[C@@H]1C(C)(C)[C@@H]2CC[C@H]3C.
What is the InChIKey of (1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane?
The InChIKey is SODGFMASLAAZRW-UKTARXLSSA-N. The full InChI is InChI=1S/C15H24/c1-10-9-15-8-7-12(10)14(3,4)13(15)6-5-11(15)2/h11-13H,1,5-9H2,2-4H3/t11-,12+,13+,15-/m1/s1.
What are the key properties of (1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane?
(1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]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 (1R,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.2.2.01,5]undecane is sourced from PubChem (CID 91750164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).