1-naphthalen-2-ylacridine

C23H15N — CID 91364116

IUPAC1-naphthalen-2-ylacridine
SMILESc1ccc2cc(-c3cccc4nc5ccccc5cc34)ccc2c1
InChIInChI=1S/C23H15N/c1-2-7-17-14-18(13-12-16(17)6-1)20-9-5-11-23-21(20)15-19-8-3-4-10-22(19)24-23/h1-15H
InChIKeyAXWZPDJXTXUOLC-UHFFFAOYSA-N
MW305.38 g/mol
LogP6.21
Rot. Bonds1

About 1-naphthalen-2-ylacridine

1-naphthalen-2-ylacridine (PubChem CID 91364116) has the molecular formula C23H15N and a molecular weight of 305.38 g/mol. Its IUPAC name is 1-naphthalen-2-ylacridine.

Molecular Properties

Compound Name1-naphthalen-2-ylacridine
PubChem CID91364116
Molecular FormulaC23H15N
Molecular Weight305.38 g/mol
Exact Mass305.12
IUPAC Name1-naphthalen-2-ylacridine
SMILESc1ccc2cc(-c3cccc4nc5ccccc5cc34)ccc2c1
InChIInChI=1S/C23H15N/c1-2-7-17-14-18(13-12-16(17)6-1)20-9-5-11-23-21(20)15-19-8-3-4-10-22(19)24-23/h1-15H
InChIKeyAXWZPDJXTXUOLC-UHFFFAOYSA-N
XLogP6.21
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500305.38
LogP ≤ 56.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-ylacridine?
The IUPAC name of 1-naphthalen-2-ylacridine (CID 91364116) is 1-naphthalen-2-ylacridine.
What is the SMILES notation for 1-naphthalen-2-ylacridine?
The canonical SMILES for 1-naphthalen-2-ylacridine is c1ccc2cc(-c3cccc4nc5ccccc5cc34)ccc2c1.
What is the InChIKey of 1-naphthalen-2-ylacridine?
The InChIKey is AXWZPDJXTXUOLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15N/c1-2-7-17-14-18(13-12-16(17)6-1)20-9-5-11-23-21(20)15-19-8-3-4-10-22(19)24-23/h1-15H.
What are the key properties of 1-naphthalen-2-ylacridine?
1-naphthalen-2-ylacridine has a molecular weight of 305.38 g/mol, XLogP of 6.21, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-ylacridine is sourced from PubChem (CID 91364116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).