(1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane

C15H24 — CID 162997310

IUPAC(1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane
SMILESCC1(C)CCC[C@]2(C)[C@H]3C[C@@H]4[C@H]([C@H]31)[C@@]42C
InChIInChI=1S/C15H24/c1-13(2)6-5-7-14(3)9-8-10-12(11(9)13)15(10,14)4/h9-12H,5-8H2,1-4H3/t9-,10+,11-,12+,14+,15+/m0/s1
InChIKeyWCEIQUQVIOGRBF-NMAMFNKQSA-N
MW204.36 g/mol
LogP4.10
Rot. Bonds

About (1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane

(1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane (PubChem CID 162997310) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is (1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane.

Molecular Properties

Compound Name(1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane
PubChem CID162997310
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name(1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane
SMILESCC1(C)CCC[C@]2(C)[C@H]3C[C@@H]4[C@H]([C@H]31)[C@@]42C
InChIInChI=1S/C15H24/c1-13(2)6-5-7-14(3)9-8-10-12(11(9)13)15(10,14)4/h9-12H,5-8H2,1-4H3/t9-,10+,11-,12+,14+,15+/m0/s1
InChIKeyWCEIQUQVIOGRBF-NMAMFNKQSA-N
XLogP4.10
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 ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]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 (1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane?
The IUPAC name of (1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane (CID 162997310) is (1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane.
What is the SMILES notation for (1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane?
The canonical SMILES for (1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane is CC1(C)CCC[C@]2(C)[C@H]3C[C@@H]4[C@H]([C@H]31)[C@@]42C.
What is the InChIKey of (1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane?
The InChIKey is WCEIQUQVIOGRBF-NMAMFNKQSA-N. The full InChI is InChI=1S/C15H24/c1-13(2)6-5-7-14(3)9-8-10-12(11(9)13)15(10,14)4/h9-12H,5-8H2,1-4H3/t9-,10+,11-,12+,14+,15+/m0/s1.
What are the key properties of (1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane?
(1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane has a molecular weight of 204.36 g/mol, XLogP of 4.10, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2R,7S,8R,9R,10R)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane is sourced from PubChem (CID 162997310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).