2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol

C11H20O — CID 10997441

IUPAC2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol
SMILESC=C1CCCC(C)(C)[C@H]1CCO
InChIInChI=1S/C11H20O/c1-9-5-4-7-11(2,3)10(9)6-8-12/h10,12H,1,4-8H2,2-3H3/t10-/m0/s1
InChIKeyHOVWQPMBTGJSHL-JTQLQIEISA-N
MW168.28 g/mol
LogP2.75
Rot. Bonds2

About 2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol

2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol (PubChem CID 10997441) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol.

Molecular Properties

Compound Name2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol
PubChem CID10997441
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol
SMILESC=C1CCCC(C)(C)[C@H]1CCO
InChIInChI=1S/C11H20O/c1-9-5-4-7-11(2,3)10(9)6-8-12/h10,12H,1,4-8H2,2-3H3/t10-/m0/s1
InChIKeyHOVWQPMBTGJSHL-JTQLQIEISA-N
XLogP2.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3,7-Dimethyl-7-octen-1-ol
CID 543323
Rhodinol
CID 81263
Grandisol
CID 169202
Albicanol
CID 171360
Cyclohexanepropanol, alpha,2,2-trimethyl-6-methylene-
CID 114559
(4-(Prop-1-en-2-yl)cyclohexyl)methanol
CID 519954
(-)-Elema-1,3,11(13)-trien-12-ol
CID 11564800
p-Menth-1(7)-en-9-ol
CID 564610
Cyclobutaneethanol, 1-methyl-2-(1-methylethenyl)-, (1R-cis)-
CID 6432285
Allohimachalol
CID 10585158
Cyclobutaneethanol, 1-methyl-2-(1-methylethenyl)-, (1R,2S)-rel-
CID 117314
2-(4-Methylcyclohexyl)prop-2-en-1-ol
CID 543946

Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol?
The IUPAC name of 2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol (CID 10997441) is 2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol.
What is the SMILES notation for 2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol?
The canonical SMILES for 2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol is C=C1CCCC(C)(C)[C@H]1CCO.
What is the InChIKey of 2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol?
The InChIKey is HOVWQPMBTGJSHL-JTQLQIEISA-N. The full InChI is InChI=1S/C11H20O/c1-9-5-4-7-11(2,3)10(9)6-8-12/h10,12H,1,4-8H2,2-3H3/t10-/m0/s1.
What are the key properties of 2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol?
2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol has a molecular weight of 168.28 g/mol, XLogP of 2.75, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethanol is sourced from PubChem (CID 10997441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).