2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol

C13H26O2 — CID 79570834

IUPAC2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol
SMILESCCOCC(C)(C)C1CCC(C)CC1O
InChIInChI=1S/C13H26O2/c1-5-15-9-13(3,4)11-7-6-10(2)8-12(11)14/h10-12,14H,5-9H2,1-4H3
InChIKeyBMAKOSWWLNEMGO-UHFFFAOYSA-N
MW214.35 g/mol
LogP2.85
Rot. Bonds4

About 2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol

2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol (PubChem CID 79570834) has the molecular formula C13H26O2 and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol.

Molecular Properties

Compound Name2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol
PubChem CID79570834
Molecular FormulaC13H26O2
Molecular Weight214.35 g/mol
Exact Mass214.19
IUPAC Name2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol
SMILESCCOCC(C)(C)C1CCC(C)CC1O
InChIInChI=1S/C13H26O2/c1-5-15-9-13(3,4)11-7-6-10(2)8-12(11)14/h10-12,14H,5-9H2,1-4H3
InChIKeyBMAKOSWWLNEMGO-UHFFFAOYSA-N
XLogP2.85
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol
CID 64766519
5-methyl-2-(2-methylnonan-2-yl)cyclohexan-1-ol
CID 64766694
(1S,2S,5R)-2-tert-butyl-5-methylcyclohexan-1-ol
CID 92529738
(1R,2S,5R)-2-tert-butyl-5-methylcyclohexan-1-ol
CID 68635053
(1R,2S,5R)-5-methyl-2-(2-methylpent-4-en-2-yl)cyclohexan-1-ol
CID 130130703
(1R,2R,5S)-2-(2-hydroxypropan-2-yl)-5-methylcyclohexan-1-ol;(1R,2S,5R)-2-(2-hydroxypropan-2-yl)-5-methylcyclohexan-1-ol;(1S,2R,5S)-2-(2-hydroxypropan-2-yl)-5-methylcyclohexan-1-ol;(1S,2S,5R)-2-(2-hydroxypropan-2-yl)-5-methylcyclohexan-1-ol
CID 167591584
5-methyl-2-[2-methyl-1-(1,3-thiazol-2-yl)propan-2-yl]cyclohexan-1-ol
CID 79824748
2-(2,3-dimethylbutan-2-yl)-5-methylcyclohexan-1-ol
CID 64766518
(1R)-4-methylcyclohexane-1,2-diol
CID 89138285
2-(5-ethoxy-2-methylpentan-2-yl)-5-methylcyclohexan-1-amine
CID 65177960
2-[1-(4-iodophenyl)-2-methylpropan-2-yl]-5-methylcyclohexan-1-ol
CID 65490567
2-[1-(4-bromophenyl)-2-methylpropan-2-yl]-5-methylcyclohexan-1-ol
CID 64767313

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol?
The IUPAC name of 2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol (CID 79570834) is 2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol.
What is the SMILES notation for 2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol?
The canonical SMILES for 2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol is CCOCC(C)(C)C1CCC(C)CC1O.
What is the InChIKey of 2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol?
The InChIKey is BMAKOSWWLNEMGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O2/c1-5-15-9-13(3,4)11-7-6-10(2)8-12(11)14/h10-12,14H,5-9H2,1-4H3.
What are the key properties of 2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol?
2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol has a molecular weight of 214.35 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol is sourced from PubChem (CID 79570834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).