dimethyl({6-methylimidazo[1,2-a]pyridin-3-yl}methyl)amine

• ChemBase ID: 42487
• Molecular Formular: C11H15N3
• Molecular Mass: 189.2569
• Monoisotopic Mass: 189.1265975
• SMILES: n12c(cnc1ccc(c2)C)CN(C)C
• Canonical SMILES: CN(Cc1cnc2n1cc(C)cc2)C
• InChI: InChI=1S/C11H15N3/c1-9-4-5-11-12-6-10(8-13(2)3)14(11)7-9/h4-7H,8H2,1-3H3
• InChIKey: UIANWMYNGANQOS-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dimethyl({6-methylimidazo[1,2-a]pyridin-3-yl}methyl)amine
• IUPAC Traditional name: dimethyl({6-methylimidazo[1,2-a]pyridin-3-yl}methyl)amine
• Synonyms: N,N-dimethyl(6-methylimidazo[1,2-a]pyridin-3-yl)methanamine; N,N-Dimethyl(6-methylimidazo[1,2-a]pyridin-3-yl)methylamine; 3-[(Dimethylamino)methyl]-6-methylimidazo[1,2-a]pyridine; N,N-Dimethyl(6-methylimidazo[1,2-a]pyridin-3-yl)-methanamine

Database IDs

• MDL Number: MFCD06200990
• PubChem SID: 162047250
• PubChem CID: 2764452

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -1.5395088
• LogD (pH = 7.4): 0.31435344
• Log P: 1.1343687
• Molar Refractivity: 59.3978 cm^3
• Polarizability: 22.10579 Å^3
• Polar Surface Area: 20.54 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 82 - 84 °C; 82-84°C

Safety Information

• Storage Warning: IRRITANT; Irritant
• TSCA Listed: false

Product Information

• Purity: >95%