Methanone,(2-aminophenyl)-2-pyridinyl- (42471-56-7)

The systematic name of 2-(2-Aminobenzoyl)pyridine is (2-aminophenyl)(pyridin-2-yl)methanone. With the CAS registry number 42471-56-7, it is also named as (2-Aminophenyl)pyridin-2-ylmethanone. The product's molecular formula is C₁₂H₁₀N₂O and its molecular weight is 198.22. 

The other characteristics of 2-(2-Aminobenzoyl)pyridine can be summarized as: (1)ACD/LogP: 1.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.2; (4)ACD/LogD (pH 7.4): 1.2; (5)ACD/BCF (pH 5.5): 4.77; (6)ACD/BCF (pH 7.4): 4.77; (7)ACD/KOC (pH 5.5): 106.54; (8)ACD/KOC (pH 7.4): 106.54; (9)H bond acceptors: 3; (10)H bond donors: 2; (11)Freely Rotating Bonds: 3; (12)Polar Surface Area: 33.2 Å²; (13)Index of Refraction: 1.634; (14)Molar Refractivity: 58.37 cm³; (15)Molar Volume: 163 cm³; (16)Polarizability: 23.14×10^-24cm³; (17)Surface Tension: 56.4 dyne/cm; (18)Density: 1.215 g/cm³; (19)Flash Point: 202.6 °C; (20)Melting Point: 153-155 °C; (21)Enthalpy of Vaporization: 66.39 kJ/mol; (22)Boiling Point: 411.4 °C at 760 mmHg; (23)Vapour Pressure: 5.6E-07 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:O=C(c1ccccc1N)c2ncccc2
(2)InChI:InChI=1/C12H10N2O/c13-10-6-2-1-5-9(10)12(15)11-7-3-4-8-14-11/h1-8H,13H2
(3)InChIKey:WEWXXYDHYCDEKY-UHFFFAOYAO
(4)Std. InChI:InChI=1S/C12H10N2O/c13-10-6-2-1-5-9(10)12(15)11-7-3-4-8-14-11/h1-8H,13H2
(5)Std. InChIKey:WEWXXYDHYCDEKY-UHFFFAOYSA-N