9-methylbicyclo[3.3.1]nonan-9-ol

C10H18O — CID 543604

IUPAC9-methylbicyclo[3.3.1]nonan-9-ol
SMILESCC1(O)C2CCCC1CCC2
InChIInChI=1S/C10H18O/c1-10(11)8-4-2-5-9(10)7-3-6-8/h8-9,11H,2-7H2,1H3
InChIKeyJKNHBEJMRDPJIE-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.34
Rot. Bonds

About 9-methylbicyclo[3.3.1]nonan-9-ol

9-methylbicyclo[3.3.1]nonan-9-ol (PubChem CID 543604) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 9-methylbicyclo[3.3.1]nonan-9-ol.

Molecular Properties

Compound Name9-methylbicyclo[3.3.1]nonan-9-ol
PubChem CID543604
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name9-methylbicyclo[3.3.1]nonan-9-ol
SMILESCC1(O)C2CCCC1CCC2
InChIInChI=1S/C10H18O/c1-10(11)8-4-2-5-9(10)7-3-6-8/h8-9,11H,2-7H2,1H3
InChIKeyJKNHBEJMRDPJIE-UHFFFAOYSA-N
XLogP2.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-methylbicyclo[3.3.1]nonan-9-ol?
The IUPAC name of 9-methylbicyclo[3.3.1]nonan-9-ol (CID 543604) is 9-methylbicyclo[3.3.1]nonan-9-ol.
What is the SMILES notation for 9-methylbicyclo[3.3.1]nonan-9-ol?
The canonical SMILES for 9-methylbicyclo[3.3.1]nonan-9-ol is CC1(O)C2CCCC1CCC2.
What is the InChIKey of 9-methylbicyclo[3.3.1]nonan-9-ol?
The InChIKey is JKNHBEJMRDPJIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-10(11)8-4-2-5-9(10)7-3-6-8/h8-9,11H,2-7H2,1H3.
What are the key properties of 9-methylbicyclo[3.3.1]nonan-9-ol?
9-methylbicyclo[3.3.1]nonan-9-ol has a molecular weight of 154.25 g/mol, XLogP of 2.34, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methylbicyclo[3.3.1]nonan-9-ol is sourced from PubChem (CID 543604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).