(2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol

C13H24O2 — CID 14081354

IUPAC(2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol
SMILESC[C@@H]1CC[C@@]2(O1)C(C)(C)CCC[C@@]2(C)O
InChIInChI=1S/C13H24O2/c1-10-6-9-13(15-10)11(2,3)7-5-8-12(13,4)14/h10,14H,5-9H2,1-4H3/t10-,12-,13-/m1/s1
InChIKeyLJOISVFAMDWVFA-RAIGVLPGSA-N
MW212.33 g/mol
LogP2.89
Rot. Bonds

About (2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol

(2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol (PubChem CID 14081354) has the molecular formula C13H24O2 and a molecular weight of 212.33 g/mol. Its IUPAC name is (2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol.

Molecular Properties

Compound Name(2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol
PubChem CID14081354
Molecular FormulaC13H24O2
Molecular Weight212.33 g/mol
Exact Mass212.18
IUPAC Name(2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol
SMILESC[C@@H]1CC[C@@]2(O1)C(C)(C)CCC[C@@]2(C)O
InChIInChI=1S/C13H24O2/c1-10-6-9-13(15-10)11(2,3)7-5-8-12(13,4)14/h10,14H,5-9H2,1-4H3/t10-,12-,13-/m1/s1
InChIKeyLJOISVFAMDWVFA-RAIGVLPGSA-N
XLogP2.89
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.33
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol
CID 175902392
2,6,9,10,10-pentamethyl-1-oxaspiro[4.5]decan-6-ol
CID 23346571
(2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-yl) propanoate
CID 23346566
(2R,5S)-2,6,6-trimethyl-10-methylidene-1-oxaspiro[4.5]decane
CID 56843547
(5R,10R)-4,4,10-trimethylspiro[4.5]decan-10-ol
CID 102083415
(2S,4aR,8aR)-2,5,5,8a-tetramethyl-2,3,4,6-tetrahydrochromen-4a-ol
CID 11074667
(3S,5R,7R,10S)-3,10-dimethyl-4,11,12,13-tetraoxadispiro[4.1.47.25]tridecane
CID 11637098
2-methylcyclopentane-1,1,2-triol
CID 139968116
1,2,2,3-tetramethylcyclohexan-1-ol;titanium
CID 151433332
2-ethynyl-2,5-dimethyloxolane
CID 156644115
CID 58183431
CID 58183431
2-(2-hydroxy-1,2-dimethylcyclopentyl)acetic acid
CID 130647860

Frequently Asked Questions

What is the IUPAC name of (2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol?
The IUPAC name of (2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol (CID 14081354) is (2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol.
What is the SMILES notation for (2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol?
The canonical SMILES for (2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol is C[C@@H]1CC[C@@]2(O1)C(C)(C)CCC[C@@]2(C)O.
What is the InChIKey of (2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol?
The InChIKey is LJOISVFAMDWVFA-RAIGVLPGSA-N. The full InChI is InChI=1S/C13H24O2/c1-10-6-9-13(15-10)11(2,3)7-5-8-12(13,4)14/h10,14H,5-9H2,1-4H3/t10-,12-,13-/m1/s1.
What are the key properties of (2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol?
(2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol has a molecular weight of 212.33 g/mol, XLogP of 2.89, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol is sourced from PubChem (CID 14081354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).