8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one

C15H16O2 — CID 135244749

IUPAC8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one
SMILESO=C1CC2C3CC1C3C(O)C2c1ccccc1
InChIInChI=1S/C15H16O2/c16-12-7-10-9-6-11(12)14(9)15(17)13(10)8-4-2-1-3-5-8/h1-5,9-11,13-15,17H,6-7H2
InChIKeyBDYSDZLEJYHPHS-UHFFFAOYSA-N
MW228.29 g/mol
LogP1.99
Rot. Bonds1

About 8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one

8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one (PubChem CID 135244749) has the molecular formula C15H16O2 and a molecular weight of 228.29 g/mol. Its IUPAC name is 8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one.

Molecular Properties

Compound Name8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one
PubChem CID135244749
Molecular FormulaC15H16O2
Molecular Weight228.29 g/mol
Exact Mass228.12
IUPAC Name8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one
SMILESO=C1CC2C3CC1C3C(O)C2c1ccccc1
InChIInChI=1S/C15H16O2/c16-12-7-10-9-6-11(12)14(9)15(17)13(10)8-4-2-1-3-5-8/h1-5,9-11,13-15,17H,6-7H2
InChIKeyBDYSDZLEJYHPHS-UHFFFAOYSA-N
XLogP1.99
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one?
The IUPAC name of 8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one (CID 135244749) is 8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one.
What is the SMILES notation for 8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one?
The canonical SMILES for 8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one is O=C1CC2C3CC1C3C(O)C2c1ccccc1.
What is the InChIKey of 8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one?
The InChIKey is BDYSDZLEJYHPHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2/c16-12-7-10-9-6-11(12)14(9)15(17)13(10)8-4-2-1-3-5-8/h1-5,9-11,13-15,17H,6-7H2.
What are the key properties of 8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one?
8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one has a molecular weight of 228.29 g/mol, XLogP of 1.99, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxy-7-phenyltricyclo[4.3.0.03,9]nonan-4-one is sourced from PubChem (CID 135244749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).