(5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol

C15H26O — CID 134900829

IUPAC(5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol
SMILESCC1CC[C@H]2C(C)(O)C[C@@H]3CC(C)(C)CC132
InChIInChI=1S/C15H26O/c1-10-5-6-12-14(4,16)8-11-7-13(2,3)9-15(10,11)12/h10-12,16H,5-9H2,1-4H3/t10?,11-,12-,14?,15?/m0/s1
InChIKeyRHLVTIMYILXEBJ-NFXIPBLASA-N
MW222.37 g/mol
LogP3.61
Rot. Bonds

About (5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol

(5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol (PubChem CID 134900829) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is (5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol.

Molecular Properties

Compound Name(5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol
PubChem CID134900829
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name(5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol
SMILESCC1CC[C@H]2C(C)(O)C[C@@H]3CC(C)(C)CC132
InChIInChI=1S/C15H26O/c1-10-5-6-12-14(4,16)8-11-7-13(2,3)9-15(10,11)12/h10-12,16H,5-9H2,1-4H3/t10?,11-,12-,14?,15?/m0/s1
InChIKeyRHLVTIMYILXEBJ-NFXIPBLASA-N
XLogP3.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.37
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3aR)-3,3a,6,8,8-pentamethyl-2,3,4,5,7,8a-hexahydro-1H-azulene-5,6-diol
CID 166082831
(1S,2R,5R,8R)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undec-6-ene
CID 12772484
(1R,4S,5R,6R,10R)-4,10-dimethyl-7-propan-2-yltricyclo[4.4.0.01,5]decan-4-ol
CID 122541122
(2R,5R,8S)-2,10,10-trimethyltricyclo[6.3.0.01,5]undec-6-ene-6-carbaldehyde
CID 56928137
(1S)-2,6,6-trimethylbicyclo[3.1.1]heptan-1-ol
CID 175971620
(1S,2S,5S,7S)-2,6,6,7-tetramethyltricyclo[6.2.1.01,5]undecan-7-ol
CID 42608184
(3R,3aR,5S,6R)-3a-ethyl-3,6,8,8-tetramethyl-2,3,4,5,7,8a-hexahydro-1H-azulene-5,6-diol
CID 155483870
(1R,3R,4R)-1,3,4-trimethylcyclopentane-1,3-diol
CID 10486972
ethyl (1S,2S,5S,8R)-2,10,10-trimethyl-7-oxotricyclo[6.3.0.01,5]undecane-6-carboxylate
CID 10356213
trans-(1R,2S)-2-(hydroxymethyl)-1,5,5-trimethylcycloheptan-1-ol
CID 14359263
1-cycloheptyl-3,3,5-trimethylcyclohexan-1-ol
CID 82928785
(1R,4R,5R,6R,7R,10R)-7-(2-hydroxypropan-2-yl)-4,10-dimethyltricyclo[4.4.0.01,5]decan-4-ol
CID 163037310

Frequently Asked Questions

What is the IUPAC name of (5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol?
The IUPAC name of (5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol (CID 134900829) is (5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol.
What is the SMILES notation for (5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol?
The canonical SMILES for (5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol is CC1CC[C@H]2C(C)(O)C[C@@H]3CC(C)(C)CC132.
What is the InChIKey of (5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol?
The InChIKey is RHLVTIMYILXEBJ-NFXIPBLASA-N. The full InChI is InChI=1S/C15H26O/c1-10-5-6-12-14(4,16)8-11-7-13(2,3)9-15(10,11)12/h10-12,16H,5-9H2,1-4H3/t10?,11-,12-,14?,15?/m0/s1.
What are the key properties of (5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol?
(5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol has a molecular weight of 222.37 g/mol, XLogP of 3.61, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R,8S)-2,6,10,10-tetramethyltricyclo[6.3.0.01,5]undecan-6-ol is sourced from PubChem (CID 134900829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).