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CAS No.: | 1762-51-2 |
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Name: | 1-Benzyl-4-(dimethylamino)piperidine-4-carboxamide |
Molecular Structure: | |
Formula: | C15H23N3O |
Molecular Weight: | 261.367 |
Synonyms: | 1-Benzyl-4-(dimethylamino)piperidine-4-carboxamide; |
EINECS: | 217-174-0 |
Density: | 1.12 g/cm3 |
Boiling Point: | 420.7 °C at 760 mmHg |
Flash Point: | 208.2 °C |
PSA: | 49.57000 |
LogP: | 1.70630 |
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This chemical is called 1-Benzyl-4-(dimethylamino)piperidine-4-carboxamide. With the molecular formula of C15H23N3O, its molecular weight is 261.36. The CAS registry number of this chemical is 1762-51-2.
Other characteristics of the 1-Benzyl-4-(dimethylamino)piperidine-4-carboxamide can be summarised as followings: (1)ACD/LogP: 0.85; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.41; (4)ACD/LogD (pH 7.4): 0.28; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 18.8; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 26.79 Å2; (13)Index of Refraction: 1.582; (14)Molar Refractivity: 77.89 cm3; (15)Molar Volume: 233.1 cm3; (16)Polarizability: 30.87×10-24cm3; (17)Surface Tension: 49.5 dyne/cm; (18)Density: 1.12 g/cm3; (19)Flash Point: 208.2 °C; (20)Enthalpy of Vaporization: 67.46 kJ/mol; (21)Boiling Point: 420.7 °C at 760 mmHg; (22)Vapour Pressure: 2.75E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(N)C2(N(C)C)CCN(Cc1ccccc1)CC2
2.InChI: InChI=1/C15H23N3O/c1-17(2)15(14(16)19)8-10-18(11-9-15)12-13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3,(H2,16,19)
3.InChIKey: CTTXVHBXEKXREE-UHFFFAOYAW