(1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol

C10H18O — CID 143765864

IUPAC(1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol
SMILESCC[C@]12CC[C@@](C)(O)[C@H]1[C@H]2C
InChIInChI=1S/C10H18O/c1-4-10-6-5-9(3,11)8(10)7(10)2/h7-8,11H,4-6H2,1-3H3/t7-,8-,9-,10-/m1/s1
InChIKeyFURLSHPREHZPJE-ZYUZMQFOSA-N
MW154.25 g/mol
LogP2.19
Rot. Bonds1

About (1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol

(1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol (PubChem CID 143765864) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol.

Molecular Properties

Compound Name(1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol
PubChem CID143765864
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol
SMILESCC[C@]12CC[C@@](C)(O)[C@H]1[C@H]2C
InChIInChI=1S/C10H18O/c1-4-10-6-5-9(3,11)8(10)7(10)2/h7-8,11H,4-6H2,1-3H3/t7-,8-,9-,10-/m1/s1
InChIKeyFURLSHPREHZPJE-ZYUZMQFOSA-N
XLogP2.19
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol?
The IUPAC name of (1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol (CID 143765864) is (1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol.
What is the SMILES notation for (1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol?
The canonical SMILES for (1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol is CC[C@]12CC[C@@](C)(O)[C@H]1[C@H]2C.
What is the InChIKey of (1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol?
The InChIKey is FURLSHPREHZPJE-ZYUZMQFOSA-N. The full InChI is InChI=1S/C10H18O/c1-4-10-6-5-9(3,11)8(10)7(10)2/h7-8,11H,4-6H2,1-3H3/t7-,8-,9-,10-/m1/s1.
What are the key properties of (1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol?
(1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol has a molecular weight of 154.25 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2R,5R,6R)-5-ethyl-2,6-dimethylbicyclo[3.1.0]hexan-2-ol is sourced from PubChem (CID 143765864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).