4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol

C13H24O2 — CID 103137306

IUPAC4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol
SMILESCC1CCC(O)C(CC2CCC(C)O2)C1
InChIInChI=1S/C13H24O2/c1-9-3-6-13(14)11(7-9)8-12-5-4-10(2)15-12/h9-14H,3-8H2,1-2H3
InChIKeySAPYGUBPFWLYQX-UHFFFAOYSA-N
MW212.33 g/mol
LogP2.74
Rot. Bonds2

About 4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol

4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol (PubChem CID 103137306) has the molecular formula C13H24O2 and a molecular weight of 212.33 g/mol. Its IUPAC name is 4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol
PubChem CID103137306
Molecular FormulaC13H24O2
Molecular Weight212.33 g/mol
Exact Mass212.18
IUPAC Name4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol
SMILESCC1CCC(O)C(CC2CCC(C)O2)C1
InChIInChI=1S/C13H24O2/c1-9-3-6-13(14)11(7-9)8-12-5-4-10(2)15-12/h9-14H,3-8H2,1-2H3
InChIKeySAPYGUBPFWLYQX-UHFFFAOYSA-N
XLogP2.74
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.33
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,5S)-2-[[(2R)-5-fluoro-2-methylcyclohexyl]methyl]-5-methyloxolane
CID 70325719
N-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine
CID 103131753
2-(2,2-dimethylpropyl)-4-methylcyclohexan-1-ol
CID 58331735
2-[(2-chlorocyclohexyl)methyl]-5-methyloxolane
CID 103131719
4-ethyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-amine
CID 103135848
3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine
CID 114543980
4-methyl-2-(2,2,2-trifluoroethyl)cyclohexan-1-ol
CID 79423179
(3R,4S)-1-[(5-methyloxolan-2-yl)methyl]pyrrolidine-3,4-diol
CID 103137660
(2R,3S,6R)-6-methyloxane-2,3-diol
CID 101435128
4-methyl-2-(3-methylbut-3-enyl)cyclohexan-1-ol
CID 114476472
2-(2-ethyl-2-hydroxybutyl)-4-methylcyclohexan-1-ol
CID 114496725
N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine
CID 103131899

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol?
The IUPAC name of 4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol (CID 103137306) is 4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol?
The canonical SMILES for 4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol is CC1CCC(O)C(CC2CCC(C)O2)C1.
What is the InChIKey of 4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol?
The InChIKey is SAPYGUBPFWLYQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O2/c1-9-3-6-13(14)11(7-9)8-12-5-4-10(2)15-12/h9-14H,3-8H2,1-2H3.
What are the key properties of 4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol?
4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol has a molecular weight of 212.33 g/mol, XLogP of 2.74, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 103137306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).