2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol

C14H26O3 — CID 11118239

IUPAC2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol
SMILESCC1(C)CC[C@H]([C@]2(C)CC[C@H](C(C)(C)O)O2)O1
InChIInChI=1S/C14H26O3/c1-12(2)8-6-11(16-12)14(5)9-7-10(17-14)13(3,4)15/h10-11,15H,6-9H2,1-5H3/t10-,11-,14+/m1/s1
InChIKeyYXRKOWVIIRRAMG-GYSYKLTISA-N
MW242.36 g/mol
LogP2.65
Rot. Bonds2

About 2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol

2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol (PubChem CID 11118239) has the molecular formula C14H26O3 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol.

Molecular Properties

Compound Name2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol
PubChem CID11118239
Molecular FormulaC14H26O3
Molecular Weight242.36 g/mol
Exact Mass242.19
IUPAC Name2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol
SMILESCC1(C)CC[C@H]([C@]2(C)CC[C@H](C(C)(C)O)O2)O1
InChIInChI=1S/C14H26O3/c1-12(2)8-6-11(16-12)14(5)9-7-10(17-14)13(3,4)15/h10-11,15H,6-9H2,1-5H3/t10-,11-,14+/m1/s1
InChIKeyYXRKOWVIIRRAMG-GYSYKLTISA-N
XLogP2.65
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol with MolForge

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Related Compounds

(1R)-1-[(2R,5R)-5-[(2R,5R)-5-[(1R)-1-hydroxy-5-propyloctyl]oxolan-2-yl]oxolan-2-yl]undecan-1-ol
CID 44413253
(1R)-5-ethyl-1-[(2R,5R)-5-[(2R,5R)-5-[(1R)-5-ethyl-1-hydroxynonyl]oxolan-2-yl]oxolan-2-yl]nonan-1-ol
CID 44413378
(1R)-1-[(2R,5R)-5-[(2R,5R)-5-[(1R)-1-hydroxy-5-propyloctyl]oxolan-2-yl]oxolan-2-yl]-5-propyloctan-1-ol
CID 44413254
Lycopanerol F
CID 101057039
2-(5-Methyl-5-(oxiran-2-yl)-tetrahydrofuran-2-yl)propan-1-ol
CID 91264076
2-(1-Hydroxy-1-methylethyl)-5-methyltetrahydrofuran
CID 13346424
2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol
CID 10909691
5-Ethenyl-alpha,alpha,5-trimethyl-2-furanmethanol, tetrahydro
CID 13616671
2-[(2R,5R)-5-[(2S,5R)-5-[(2S,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol
CID 44303227
2-[(2R,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol
CID 44303261
2-[(2S,5S)-5-[(2R,5S)-5-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol
CID 44303283
(2S,6R,10R)-2-[(2R,5R)-5-[(2S,6R,10R)-2-[(2R,6R,10R)-2-[(2R,5R)-5-[(2R,6R,10R)-2-[(2S,6R,10R)-2-[(2R,5R)-5-[(2R,6R,10R)-2-hydroxy-6,10,14-trimethylpentadecan-2-yl]oxolan-2-yl]-6,10,14-trimethylpentadecan-2-yl]oxy-6,10,14-trimethylpentadecan-2-yl]oxolan-2-yl]-6,10,14-trimethylpentadecan-2-yl]oxy-6,10,14-trimethylpentadecan-2-yl]oxolan-2-yl]-6,10,14-trimethylpentadecan-2-ol
CID 163057227

Frequently Asked Questions

What is the IUPAC name of 2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol?
The IUPAC name of 2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol (CID 11118239) is 2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol.
What is the SMILES notation for 2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol?
The canonical SMILES for 2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol is CC1(C)CC[C@H]([C@]2(C)CC[C@H](C(C)(C)O)O2)O1.
What is the InChIKey of 2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol?
The InChIKey is YXRKOWVIIRRAMG-GYSYKLTISA-N. The full InChI is InChI=1S/C14H26O3/c1-12(2)8-6-11(16-12)14(5)9-7-10(17-14)13(3,4)15/h10-11,15H,6-9H2,1-5H3/t10-,11-,14+/m1/s1.
What are the key properties of 2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol?
2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol has a molecular weight of 242.36 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R,5S)-5-[(2R)-5,5-dimethyloxolan-2-yl]-5-methyloxolan-2-yl]propan-2-ol is sourced from PubChem (CID 11118239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).