1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol

C11H20O — CID 20721971

IUPAC1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol
SMILESCC(O)C1CC2CC1C(C)C2C
InChIInChI=1S/C11H20O/c1-6-7(2)10-4-9(6)5-11(10)8(3)12/h6-12H,4-5H2,1-3H3
InChIKeyIUKFYNNXBUNKNH-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.30
Rot. Bonds1

About 1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol

1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol (PubChem CID 20721971) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol.

Molecular Properties

Compound Name1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol
PubChem CID20721971
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol
SMILESCC(O)C1CC2CC1C(C)C2C
InChIInChI=1S/C11H20O/c1-6-7(2)10-4-9(6)5-11(10)8(3)12/h6-12H,4-5H2,1-3H3
InChIKeyIUKFYNNXBUNKNH-UHFFFAOYSA-N
XLogP2.30
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-cyclopropylcyclopropyl)ethanol
CID 130149488
1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)-5-(1,3-dioxolan-2-yl)pentan-1-ol
CID 23560915
1-(2-ethyl-3-bicyclo[3.1.0]hexanyl)ethanol
CID 89331545
(5R)-2,3,5-trimethylbicyclo[2.2.1]heptane
CID 59217509
1-(2-bicyclo[2.1.0]pentanyl)-2-methylpropan-1-ol
CID 89099272
2-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)-1-fluoroethanol
CID 23405415
2,3-dimethyl-5-methylbicyclo[2.2.1]heptane
CID 144530808
1-(2-bicyclo[2.1.1]hexanyl)ethanol
CID 105427290
2-hydroxypropyl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;methane
CID 162025436
methyl 4-[4-[6-(1-hydroxyethyl)-3-methyl-2-bicyclo[2.2.1]heptanyl]-2,5-dioxooxolan-3-yl]-2,2-dimethylbutanoate
CID 20692404
butan-2-ol;5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylic acid;2-hydroxyethyl 2,2-dimethylbutanoate
CID 162026205
2-(1-hydroxyethyl)-4,5-dimethylcyclohexan-1-ol
CID 23443116

Frequently Asked Questions

What is the IUPAC name of 1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol?
The IUPAC name of 1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol (CID 20721971) is 1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol.
What is the SMILES notation for 1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol?
The canonical SMILES for 1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol is CC(O)C1CC2CC1C(C)C2C.
What is the InChIKey of 1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol?
The InChIKey is IUKFYNNXBUNKNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-6-7(2)10-4-9(6)5-11(10)8(3)12/h6-12H,4-5H2,1-3H3.
What are the key properties of 1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol?
1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol has a molecular weight of 168.28 g/mol, XLogP of 2.30, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol is sourced from PubChem (CID 20721971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).