5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol

C13H26O — CID 64766519

IUPAC5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol
SMILESCCCC(C)(C)C1CCC(C)CC1O
InChIInChI=1S/C13H26O/c1-5-8-13(3,4)11-7-6-10(2)9-12(11)14/h10-12,14H,5-9H2,1-4H3
InChIKeyIKRWUIFZQYUFTE-UHFFFAOYSA-N
MW198.35 g/mol
LogP3.61
Rot. Bonds3

About 5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol

5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol (PubChem CID 64766519) has the molecular formula C13H26O and a molecular weight of 198.35 g/mol. Its IUPAC name is 5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol
PubChem CID64766519
Molecular FormulaC13H26O
Molecular Weight198.35 g/mol
Exact Mass198.20
IUPAC Name5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol
SMILESCCCC(C)(C)C1CCC(C)CC1O
InChIInChI=1S/C13H26O/c1-5-8-13(3,4)11-7-6-10(2)9-12(11)14/h10-12,14H,5-9H2,1-4H3
InChIKeyIKRWUIFZQYUFTE-UHFFFAOYSA-N
XLogP3.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-methyl-2-(2-methylnonan-2-yl)cyclohexan-1-ol
CID 64766694
2-(1-ethoxy-2-methylpropan-2-yl)-5-methylcyclohexan-1-ol
CID 79570834
(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
N-[2-(2-hydroxy-4-methylcyclohexyl)propan-2-yl]propanamide
CID 5106343
2-(2,3-dimethylbutan-2-yl)-5-methylcyclohexan-1-ol
CID 64766518
(1R)-4-methylcyclohexane-1,2-diol
CID 89138285
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
2,5-dimethylcyclohexan-1-ol;propane
CID 142087287

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol?
The IUPAC name of 5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol (CID 64766519) is 5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol.
What is the SMILES notation for 5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol?
The canonical SMILES for 5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol is CCCC(C)(C)C1CCC(C)CC1O.
What is the InChIKey of 5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol?
The InChIKey is IKRWUIFZQYUFTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O/c1-5-8-13(3,4)11-7-6-10(2)9-12(11)14/h10-12,14H,5-9H2,1-4H3.
What are the key properties of 5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol?
5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol has a molecular weight of 198.35 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol is sourced from PubChem (CID 64766519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).