2-Methyl-4-(1-piperidinyl)-pyridine

The Pyridine, 2-methyl-4-(1-piperidinyl)-, with the CAS registry number 103971-16-0, is also known as 2-Methyl-4-(1-piperidinyl)-pyridine. This chemical's molecular formula is C₁₁H₁₆N₂ and molecular weight is 176.26. What's more, its systematic name is 2-Methyl-4-piperidin-1-ylpyridine.

Physical properties about Pyridine, 2-methyl-4-(1-piperidinyl)- are: (1)ACD/LogP: 2.45; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1.63; (6)ACD/KOC (pH 7.4): 1.65; (7)#H bond acceptors: 2; (8)#H bond donors: 0; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 16.13 Å²; (11)Index of Refraction: 1.543; (12)Molar Refractivity: 53.98 cm³; (13)Molar Volume: 171.2 cm³; (14)Polarizability: 21.4×10^-24 cm³; (15)Surface Tension: 41.5 dyne/cm; (16)Density: 1.029 g/cm³; (17)Flash Point: 137.8 °C; (18)Enthalpy of Vaporization: 54.46 kJ/mol; (19)Boiling Point: 304.2 °C at 760 mmHg; (20)Vapour Pressure: 0.000887 mmHg at 25 °C.

Preparation of Pyridine, 2-methyl-4-(1-piperidinyl)-: this chemical is prepared by reaction of 4-Chloro-2-methyl-pyridine with Piperidine. The reaction time is 4.5 hours with reaction temperature of 170 °C. The yield is about 82 %.

Uses of Pyridine, 2-methyl-4-(1-piperidinyl)-: it is used to produce other chemicals. For example, it is used to produce 3-Bromo-2-methyl-4-piperidinopyridine. This reaction needs reagents Br₂ and K₂CO₃. Meanwhile, it needs solvent Dimethylformamide. The reaction time is 3.5 hours with reaction temperature of 25-30 °C. The yield is about 52 %.

You can still convert the following datas into molecular structure:
(1) SMILES: Cc1cc(ccn1)N2CCCCC2
(2) InChI: InChI=1/C11H16N2/c1-10-9-11(5-6-12-10)13-7-3-2-4-8-13/h5-6,9H,2-4,7-8H2,1H3
(3) InChIKey: IBKGSZATXCWQOT-UHFFFAOYAU