trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol

C11H20O — CID 66963449

IUPACtrans-(1R,3R)-3-cyclopentylcyclohexan-1-ol
SMILESO[C@@H]1CCC[C@@H](C2CCCC2)C1
InChIInChI=1S/C11H20O/c12-11-7-3-6-10(8-11)9-4-1-2-5-9/h9-12H,1-8H2/t10-,11-/m1/s1
InChIKeyBWXWUXSZLHVJPG-GHMZBOCLSA-N
MW168.28 g/mol
LogP2.73
Rot. Bonds1

About trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol

trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol (PubChem CID 66963449) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol.

Molecular Properties

Compound Nametrans-(1R,3R)-3-cyclopentylcyclohexan-1-ol
PubChem CID66963449
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Nametrans-(1R,3R)-3-cyclopentylcyclohexan-1-ol
SMILESO[C@@H]1CCC[C@@H](C2CCCC2)C1
InChIInChI=1S/C11H20O/c12-11-7-3-6-10(8-11)9-4-1-2-5-9/h9-12H,1-8H2/t10-,11-/m1/s1
InChIKeyBWXWUXSZLHVJPG-GHMZBOCLSA-N
XLogP2.73
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 ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol?
The IUPAC name of trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol (CID 66963449) is trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol.
What is the SMILES notation for trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol?
The canonical SMILES for trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol is O[C@@H]1CCC[C@@H](C2CCCC2)C1.
What is the InChIKey of trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol?
The InChIKey is BWXWUXSZLHVJPG-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H20O/c12-11-7-3-6-10(8-11)9-4-1-2-5-9/h9-12H,1-8H2/t10-,11-/m1/s1.
What are the key properties of trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol?
trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol has a molecular weight of 168.28 g/mol, XLogP of 2.73, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol is sourced from PubChem (CID 66963449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).