1H-Indole,5-fluoro-3-(1-methyl-4-piperidinyl)- (301856-29-1)

The 5-Fluoro-3-(1-methyl-4-piperidinyl)indole with its cas register number is 301856-29-1. It also can be called as 1H-Indole,5-fluoro-3-(1-methyl-4-piperidinyl)- and the IUPAC Name about this chemical is 5-fluoro-3-(1-methylpiperidin-4-yl)-1H-indole. It belongs to the pharmacetical.

Physical properties about 5-Fluoro-3-(1-methyl-4-piperidinyl)indole are: (1)ACD/LogP: 2.47; (2)ACD/LogD (pH 7.4): 0.29; (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): 3.44; (7)#H bond acceptors: 2; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Index of Refraction: 1.602; (11)Molar Refractivity: 68.04 cm³; (12)Molar Volume: 198.3 cm³; (13)Polarizability: 26.97x10^-24cm³; (14)Surface Tension: 44.5 dyne/cm; (15)Enthalpy of Vaporization: 62.44 kJ/mol; (16)Vapour Pressure: 7.11E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc3ccc1c(c(cn1)C2CCN(C)CC2)c3
(2)InChI: InChI=1/C14H17FN2/c1-17-6-4-10(5-7-17)13-9-16-14-3-2-11(15)8-12(13)14/h2-3,8-10,16H,4-7H2,1H3
(3)InChIKey: QBQNOLXBAYSVNM-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C14H17FN2/c1-17-6-4-10(5-7-17)13-9-16-14-3-2-11(15)8-12(13)14/h2-3,8-10,16H,4-7H2,1H3
(5)Std. InChIKey: QBQNOLXBAYSVNM-UHFFFAOYSA-N