(2S)-bicyclo[3.2.2]nonan-2-ol

C9H16O — CID 10749279

IUPAC(2S)-bicyclo[3.2.2]nonan-2-ol
SMILESO[C@H]1CCC2CC[13CH]1CC2
InChIInChI=1S/C9H16O/c10-9-6-3-7-1-4-8(9)5-2-7/h7-10H,1-6H2/t7?,8?,9-/m0/s1/i8+1
InChIKeyOUBOQSROKKBGDD-WUOFMCHBSA-N
MW141.22 g/mol
LogP1.95
Rot. Bonds

About (2S)-bicyclo[3.2.2]nonan-2-ol

(2S)-bicyclo[3.2.2]nonan-2-ol (PubChem CID 10749279) has the molecular formula C9H16O and a molecular weight of 141.22 g/mol. Its IUPAC name is (2S)-bicyclo[3.2.2]nonan-2-ol.

Molecular Properties

Compound Name(2S)-bicyclo[3.2.2]nonan-2-ol
PubChem CID10749279
Molecular FormulaC9H16O
Molecular Weight141.22 g/mol
Exact Mass141.12
IUPAC Name(2S)-bicyclo[3.2.2]nonan-2-ol
SMILESO[C@H]1CCC2CC[13CH]1CC2
InChIInChI=1S/C9H16O/c10-9-6-3-7-1-4-8(9)5-2-7/h7-10H,1-6H2/t7?,8?,9-/m0/s1/i8+1
InChIKeyOUBOQSROKKBGDD-WUOFMCHBSA-N
XLogP1.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.22
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2S)-bicyclo[3.2.2]nonan-2-ol?
The IUPAC name of (2S)-bicyclo[3.2.2]nonan-2-ol (CID 10749279) is (2S)-bicyclo[3.2.2]nonan-2-ol.
What is the SMILES notation for (2S)-bicyclo[3.2.2]nonan-2-ol?
The canonical SMILES for (2S)-bicyclo[3.2.2]nonan-2-ol is O[C@H]1CCC2CC[13CH]1CC2.
What is the InChIKey of (2S)-bicyclo[3.2.2]nonan-2-ol?
The InChIKey is OUBOQSROKKBGDD-WUOFMCHBSA-N. The full InChI is InChI=1S/C9H16O/c10-9-6-3-7-1-4-8(9)5-2-7/h7-10H,1-6H2/t7?,8?,9-/m0/s1/i8+1.
What are the key properties of (2S)-bicyclo[3.2.2]nonan-2-ol?
(2S)-bicyclo[3.2.2]nonan-2-ol has a molecular weight of 141.22 g/mol, XLogP of 1.95, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-bicyclo[3.2.2]nonan-2-ol is sourced from PubChem (CID 10749279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).