3-Piperidinemethanamine,1-methyl- (14613-37-7)

The 3-(Aminomethyl)-1-methylpiperidine, with cas registry number 14613-37-7, has the systematic name of 1-(1-methylpiperidin-3-yl)methanamine. It is also called C-(1-methyl-piperidin-3-yl)-methylamine, hcl.

Physical properties about this chemical are: (1)ACD/LogP: 0.28; (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; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 29.26 Å²; (11)Index of Refraction: 1.468; (12)Molar Refractivity: 39.562 cm³; (13)Molar Volume: 142.251 cm³; (14)Polarizability: 15.684×10^-24cm³; (15)Surface Tension: 30.681 dyne/cm; (16)Enthalpy of Vaporization: 39.209 kJ/mol; (17)Vapour Pressure: 3.043 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES: NCC1CCCN(C)C1
(2)InChI: InChI=1/C7H16N2/c1-9-4-2-3-7(5-8)6-9/h7H,2-6,8H2,1H3
(3)InChIKey: KEDTYNCWGSIWBK-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C7H16N2/c1-9-4-2-3-7(5-8)6-9/h7H,2-6,8H2,1H3
(5)Std. InChIKey: KEDTYNCWGSIWBK-UHFFFAOYSA-N