bicyclo[5.3.1]undecan-1-ol

C11H20O — CID 14867023

IUPACbicyclo[5.3.1]undecan-1-ol
SMILESOC12CCCCCC(CCC1)C2
InChIInChI=1S/C11H20O/c12-11-7-3-1-2-5-10(9-11)6-4-8-11/h10,12H,1-9H2
InChIKeyBDAQJYNPUNKFOC-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.87
Rot. Bonds

About bicyclo[5.3.1]undecan-1-ol

bicyclo[5.3.1]undecan-1-ol (PubChem CID 14867023) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is bicyclo[5.3.1]undecan-1-ol.

Molecular Properties

Compound Namebicyclo[5.3.1]undecan-1-ol
PubChem CID14867023
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Namebicyclo[5.3.1]undecan-1-ol
SMILESOC12CCCCCC(CCC1)C2
InChIInChI=1S/C11H20O/c12-11-7-3-1-2-5-10(9-11)6-4-8-11/h10,12H,1-9H2
InChIKeyBDAQJYNPUNKFOC-UHFFFAOYSA-N
XLogP2.87
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of bicyclo[5.3.1]undecan-1-ol?
The IUPAC name of bicyclo[5.3.1]undecan-1-ol (CID 14867023) is bicyclo[5.3.1]undecan-1-ol.
What is the SMILES notation for bicyclo[5.3.1]undecan-1-ol?
The canonical SMILES for bicyclo[5.3.1]undecan-1-ol is OC12CCCCCC(CCC1)C2.
What is the InChIKey of bicyclo[5.3.1]undecan-1-ol?
The InChIKey is BDAQJYNPUNKFOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c12-11-7-3-1-2-5-10(9-11)6-4-8-11/h10,12H,1-9H2.
What are the key properties of bicyclo[5.3.1]undecan-1-ol?
bicyclo[5.3.1]undecan-1-ol has a molecular weight of 168.28 g/mol, XLogP of 2.87, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bicyclo[5.3.1]undecan-1-ol is sourced from PubChem (CID 14867023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).