dispiro[2.0.34.43]undecan-11-one

C11H16O — CID 121217052

IUPACdispiro[2.0.34.43]undecan-11-one
SMILESO=C1CCCC2(CCC2)C12CC2
InChIInChI=1S/C11H16O/c12-9-3-1-4-10(5-2-6-10)11(9)7-8-11/h1-8H2
InChIKeyOTCAJXVBPMEENA-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.69
Rot. Bonds

About dispiro[2.0.34.43]undecan-11-one

dispiro[2.0.34.43]undecan-11-one (PubChem CID 121217052) has the molecular formula C11H16O and a molecular weight of 164.25 g/mol. Its IUPAC name is dispiro[2.0.34.43]undecan-11-one.

Molecular Properties

Compound Namedispiro[2.0.34.43]undecan-11-one
PubChem CID121217052
Molecular FormulaC11H16O
Molecular Weight164.25 g/mol
Exact Mass164.12
IUPAC Namedispiro[2.0.34.43]undecan-11-one
SMILESO=C1CCCC2(CCC2)C12CC2
InChIInChI=1S/C11H16O/c12-9-3-1-4-10(5-2-6-10)11(9)7-8-11/h1-8H2
InChIKeyOTCAJXVBPMEENA-UHFFFAOYSA-N
XLogP2.69
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(1R,6R)-tricyclo[4.4.1.01,6]undecane-2,7-dione
CID 130765311
tricyclo[3.3.2.01,5]decan-9-one
CID 12564319
(1S,6R)-tricyclo[4.3.1.01,6]decan-7-one
CID 13167045
(1R,7S)-tricyclo[5.3.1.01,7]undecan-8-one
CID 13167047
(6R,9S)-9-(2-hydroxypropan-2-yl)tricyclo[4.4.1.01,6]undecan-2-one
CID 11969863
trispiro[3.0.0.46.25.24]tetradecan-11-one
CID 23727770
(5R)-trispiro[3.0.0.46.25.24]tetradecan-11-one
CID 23727846
10-ethenyl-10-hydroxyspiro[4.5]decan-6-one
CID 155931172
(2R)-2-hydroxy-2-methylcyclopentan-1-one
CID 13397596
2,2,3,3-tetrachlorocyclohexan-1-one
CID 54555394
(5R)-9-methylidenespiro[4.4]nonan-4-one
CID 101143196
tricyclo[5.3.2.01,7]dodec-11-en-2-one
CID 13404790

Frequently Asked Questions

What is the IUPAC name of dispiro[2.0.34.43]undecan-11-one?
The IUPAC name of dispiro[2.0.34.43]undecan-11-one (CID 121217052) is dispiro[2.0.34.43]undecan-11-one.
What is the SMILES notation for dispiro[2.0.34.43]undecan-11-one?
The canonical SMILES for dispiro[2.0.34.43]undecan-11-one is O=C1CCCC2(CCC2)C12CC2.
What is the InChIKey of dispiro[2.0.34.43]undecan-11-one?
The InChIKey is OTCAJXVBPMEENA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O/c12-9-3-1-4-10(5-2-6-10)11(9)7-8-11/h1-8H2.
What are the key properties of dispiro[2.0.34.43]undecan-11-one?
dispiro[2.0.34.43]undecan-11-one has a molecular weight of 164.25 g/mol, XLogP of 2.69, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dispiro[2.0.34.43]undecan-11-one is sourced from PubChem (CID 121217052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).