9-methylbicyclo[5.2.0]nonan-8-one

C10H16O — CID 12721699

IUPAC9-methylbicyclo[5.2.0]nonan-8-one
SMILESCC1C(=O)C2CCCCCC12
InChIInChI=1S/C10H16O/c1-7-8-5-3-2-4-6-9(8)10(7)11/h7-9H,2-6H2,1H3
InChIKeyFHKLFGDORANJBM-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.40
Rot. Bonds

About 9-methylbicyclo[5.2.0]nonan-8-one

9-methylbicyclo[5.2.0]nonan-8-one (PubChem CID 12721699) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 9-methylbicyclo[5.2.0]nonan-8-one.

Molecular Properties

Compound Name9-methylbicyclo[5.2.0]nonan-8-one
PubChem CID12721699
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name9-methylbicyclo[5.2.0]nonan-8-one
SMILESCC1C(=O)C2CCCCCC12
InChIInChI=1S/C10H16O/c1-7-8-5-3-2-4-6-9(8)10(7)11/h7-9H,2-6H2,1H3
InChIKeyFHKLFGDORANJBM-UHFFFAOYSA-N
XLogP2.40
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-methylbicyclo[5.2.0]nonan-8-one?
The IUPAC name of 9-methylbicyclo[5.2.0]nonan-8-one (CID 12721699) is 9-methylbicyclo[5.2.0]nonan-8-one.
What is the SMILES notation for 9-methylbicyclo[5.2.0]nonan-8-one?
The canonical SMILES for 9-methylbicyclo[5.2.0]nonan-8-one is CC1C(=O)C2CCCCCC12.
What is the InChIKey of 9-methylbicyclo[5.2.0]nonan-8-one?
The InChIKey is FHKLFGDORANJBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-7-8-5-3-2-4-6-9(8)10(7)11/h7-9H,2-6H2,1H3.
What are the key properties of 9-methylbicyclo[5.2.0]nonan-8-one?
9-methylbicyclo[5.2.0]nonan-8-one has a molecular weight of 152.24 g/mol, XLogP of 2.40, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methylbicyclo[5.2.0]nonan-8-one is sourced from PubChem (CID 12721699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).