acridin-2-amine

• ChemBase ID: 125248
• Molecular Formular: C13H10N2
• Molecular Mass: 194.2319
• Monoisotopic Mass: 194.08439833
• SMILES: n1c2c(cc3c1cccc3)cc(cc2)N
• Canonical SMILES: Nc1ccc2c(c1)cc1c(n2)cccc1
• InChI: InChI=1S/C13H10N2/c14-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)15-13/h1-8H,14H2
• InChIKey: UTXPWBKKZFLMPZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: acridin-2-amine
• IUPAC Traditional name: 2-aminoacridine
• Synonyms: 2-Aminoacridine

Database IDs

• CAS Number: 581-28-2
• PubChem SID: 162219598
• PubChem CID: 11384
• CHEMBL: 146566
• Chemspider ID: 10906
• Wikipedia Title: 2-Aminoacridine

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 1.750026
• LogD (pH = 7.4): 2.631892
• Log P: 2.6773016
• Molar Refractivity: 60.7579 cm^3
• Polarizability: 25.819496 Å^3
• Polar Surface Area: 38.91 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true