1,9-Diaminoacridine

C13H11N3 — CID 31623

About 1,9-Diaminoacridine

1,9-Diaminoacridine (PubChem CID 31623) has the molecular formula C13H11N3 and a molecular weight of 209.25 g/mol. Its IUPAC name is acridine-1,9-diamine.

Molecular Properties

• Compound Name: 1,9-Diaminoacridine
• PubChem CID: 31623
• Molecular Formula: C13H11N3
• Molecular Weight: 209.25 g/mol
• Exact Mass: 209.10
• IUPAC Name: acridine-1,9-diamine
• SMILES: C1=CC=C2C(=C1)C(=C3C(=N2)C=CC=C3N)N
• InChIKey: NDNCMVVGTGZIMI-UHFFFAOYSA-N
• XLogP: 2.30
• TPSA: 64.90 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 3
• Rotatable Bonds: 0
• Heavy Atoms: 16
• Complexity: 256

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	209.25
LogP ≤ 5	2.30
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'amino_acridine_A(46)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}