About 1-hydroxy-3-naphthalen-2-ylquinolin-2-one
1-hydroxy-3-naphthalen-2-ylquinolin-2-one (PubChem CID 118719511) has the molecular formula C19H13NO2
and a molecular weight of 287.32 g/mol. Its IUPAC name is 1-hydroxy-3-naphthalen-2-ylquinolin-2-one.
Molecular Properties
| Compound Name | 1-hydroxy-3-naphthalen-2-ylquinolin-2-one |
| PubChem CID | 118719511 |
| Molecular Formula | C19H13NO2 |
| Molecular Weight | 287.32 g/mol |
| Exact Mass | 287.09 |
| IUPAC Name | 1-hydroxy-3-naphthalen-2-ylquinolin-2-one |
| SMILES | O=c1c(-c2ccc3ccccc3c2)cc2ccccc2n1O |
| InChI | InChI=1S/C19H13NO2/c21-19-17(12-16-7-3-4-8-18(16)20(19)22)15-10-9-13-5-1-2-6-14(13)11-15/h1-12,22H |
| InChIKey | ZVMCOYKPUNJBBI-UHFFFAOYSA-N |
| XLogP | 4.06 |
| TPSA | 42.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 287.32 |
| LogP ≤ 5 | 4.06 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'} |
|---|
Analyze 1-hydroxy-3-naphthalen-2-ylquinolin-2-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 1-hydroxy-3-naphthalen-2-ylquinolin-2-one?
The IUPAC name of 1-hydroxy-3-naphthalen-2-ylquinolin-2-one (CID 118719511) is 1-hydroxy-3-naphthalen-2-ylquinolin-2-one.
What is the SMILES notation for 1-hydroxy-3-naphthalen-2-ylquinolin-2-one?
The canonical SMILES for 1-hydroxy-3-naphthalen-2-ylquinolin-2-one is O=c1c(-c2ccc3ccccc3c2)cc2ccccc2n1O.
What is the InChIKey of 1-hydroxy-3-naphthalen-2-ylquinolin-2-one?
The InChIKey is ZVMCOYKPUNJBBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13NO2/c21-19-17(12-16-7-3-4-8-18(16)20(19)22)15-10-9-13-5-1-2-6-14(13)11-15/h1-12,22H.
What are the key properties of 1-hydroxy-3-naphthalen-2-ylquinolin-2-one?
1-hydroxy-3-naphthalen-2-ylquinolin-2-one has a molecular weight of 287.32 g/mol, XLogP of 4.06, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-3-naphthalen-2-ylquinolin-2-one is sourced from PubChem (CID 118719511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).