5-naphthalen-1-ylquinolin-8-ol;zinc

C19H13NOZn — CID 20606771

IUPAC5-naphthalen-1-ylquinolin-8-ol;zinc
SMILESOc1ccc(-c2cccc3ccccc23)c2cccnc12.[Zn]
InChIInChI=1S/C19H13NO.Zn/c21-18-11-10-16(17-9-4-12-20-19(17)18)15-8-3-6-13-5-1-2-7-14(13)15;/h1-12,21H;
InChIKeyXWMYDKJVWYFZNF-UHFFFAOYSA-N
MW336.71 g/mol
LogP4.76
Rot. Bonds1

About 5-naphthalen-1-ylquinolin-8-ol;zinc

5-naphthalen-1-ylquinolin-8-ol;zinc (PubChem CID 20606771) has the molecular formula C19H13NOZn and a molecular weight of 336.71 g/mol. Its IUPAC name is 5-naphthalen-1-ylquinolin-8-ol;zinc.

Molecular Properties

Compound Name5-naphthalen-1-ylquinolin-8-ol;zinc
PubChem CID20606771
Molecular FormulaC19H13NOZn
Molecular Weight336.71 g/mol
Exact Mass335.03
IUPAC Name5-naphthalen-1-ylquinolin-8-ol;zinc
SMILESOc1ccc(-c2cccc3ccccc23)c2cccnc12.[Zn]
InChIInChI=1S/C19H13NO.Zn/c21-18-11-10-16(17-9-4-12-20-19(17)18)15-8-3-6-13-5-1-2-7-14(13)15;/h1-12,21H;
InChIKeyXWMYDKJVWYFZNF-UHFFFAOYSA-N
XLogP4.76
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.71
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-naphthalen-1-ylquinolin-8-ol;zinc?
The IUPAC name of 5-naphthalen-1-ylquinolin-8-ol;zinc (CID 20606771) is 5-naphthalen-1-ylquinolin-8-ol;zinc.
What is the SMILES notation for 5-naphthalen-1-ylquinolin-8-ol;zinc?
The canonical SMILES for 5-naphthalen-1-ylquinolin-8-ol;zinc is Oc1ccc(-c2cccc3ccccc23)c2cccnc12.[Zn].
What is the InChIKey of 5-naphthalen-1-ylquinolin-8-ol;zinc?
The InChIKey is XWMYDKJVWYFZNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13NO.Zn/c21-18-11-10-16(17-9-4-12-20-19(17)18)15-8-3-6-13-5-1-2-7-14(13)15;/h1-12,21H;.
What are the key properties of 5-naphthalen-1-ylquinolin-8-ol;zinc?
5-naphthalen-1-ylquinolin-8-ol;zinc has a molecular weight of 336.71 g/mol, XLogP of 4.76, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-naphthalen-1-ylquinolin-8-ol;zinc is sourced from PubChem (CID 20606771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).