(1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane

C15H26 — CID 162924951

IUPAC(1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane
SMILESC[C@H]1CC[C@@H]2C(C)(C)C[C@@]3(C)CCC[C@]213
InChIInChI=1S/C15H26/c1-11-6-7-12-13(2,3)10-14(4)8-5-9-15(11,12)14/h11-12H,5-10H2,1-4H3/t11-,12+,14+,15+/m0/s1
InChIKeyUTBQVGNGGLSSEH-CTHBEMJXSA-N
MW206.37 g/mol
LogP4.64
Rot. Bonds

About (1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane

(1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane (PubChem CID 162924951) has the molecular formula C15H26 and a molecular weight of 206.37 g/mol. Its IUPAC name is (1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane.

Molecular Properties

Compound Name(1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane
PubChem CID162924951
Molecular FormulaC15H26
Molecular Weight206.37 g/mol
Exact Mass206.20
IUPAC Name(1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane
SMILESC[C@H]1CC[C@@H]2C(C)(C)C[C@@]3(C)CCC[C@]213
InChIInChI=1S/C15H26/c1-11-6-7-12-13(2,3)10-14(4)8-5-9-15(11,12)14/h11-12H,5-10H2,1-4H3/t11-,12+,14+,15+/m0/s1
InChIKeyUTBQVGNGGLSSEH-CTHBEMJXSA-N
XLogP4.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.37
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane?
The IUPAC name of (1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane (CID 162924951) is (1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane.
What is the SMILES notation for (1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane?
The canonical SMILES for (1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane is C[C@H]1CC[C@@H]2C(C)(C)C[C@@]3(C)CCC[C@]213.
What is the InChIKey of (1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane?
The InChIKey is UTBQVGNGGLSSEH-CTHBEMJXSA-N. The full InChI is InChI=1S/C15H26/c1-11-6-7-12-13(2,3)10-14(4)8-5-9-15(11,12)14/h11-12H,5-10H2,1-4H3/t11-,12+,14+,15+/m0/s1.
What are the key properties of (1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane?
(1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane has a molecular weight of 206.37 g/mol, XLogP of 4.64, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2S,5R,8R)-2,6,6,8-tetramethyltricyclo[6.3.0.01,5]undecane is sourced from PubChem (CID 162924951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).