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Structure of 3514-15-6

Chemical Structure| 3514-15-6

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Product Details of [ 3514-15-6 ]

CAS No. :3514-15-6
Formula : C11H14N2
M.W : 174.24
SMILES Code : CN1C(CNC)=CC2=C1C=CC=C2
MDL No. :MFCD06801062
InChI Key :BMINWSYCLTUQSH-UHFFFAOYSA-N
Pubchem ID :11401058

Safety of [ 3514-15-6 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

Application In Synthesis of [ 3514-15-6 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 3514-15-6 ]

[ 3514-15-6 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 3514-15-6 ]
  • [ 167837-43-6 ]
  • [ 335027-53-7 ]
  • 2
  • HOBt · H2O [ No CAS ]
  • [ 3514-15-6 ]
  • [ 167837-43-6 ]
  • [ 335027-53-7 ]
YieldReaction ConditionsOperation in experiment
83% With 1,2-dichloro-ethane; triethylamine; In N,N-dimethyl-formamide; Example 1 Preparation of (E)-3-(6-aminopyridin-3-yl)-N-methyl-N-(1-methyl-1 H -indol-2-ylmethyl)acrylamide EDC (0.70 g, 3.7 mmole) was added to a solution of <strong>[167837-43-6](E)-<strong>[167837-43-6]3-(6-aminopyridin-3-yl)acrylic acid</strong></strong> (0.61 g, 3.7 mmole), 1-methyl-2-(methylaminomethyl)-1H-indole (0.65 g, 3.7 mmole), HOBt · H2O (0.50 g, 3.7 mmole), and triethylamine (0.52 mL, 3.7 mmole) in DMF (30 mL) at RT. The reaction was stirred overnight, then was concentrated in vacuo. The residue was diluted with 5% NaHCO3 and extracted with CH2Cl2. The combined organic extracts were washed with brine and dried over MgSO4. Flash chromatography on silica gel (3% MeOH/CH2Cl2) gave a colorless semisolid which was triturated with Et2O and dried. The title compound (1.0 g, 83%) was obtained as a white solid: 1H NMR (300 MHz, CDCl3) delta 8.20 (br s, 1 H), 7.45 - 7.70 (m, 3 H), 7.00 - 7.30 (m, 3 H), 6.69 (d, J = 15.4 Hz, 1 H), 6.30 - 6.50 (m, 2 H), 4.89 (s, 2 H), 4.67 (br s, 2 H), 3.68 (s, 3 H), 3.01 (s, 3 H); MS (ES) m/e 321 (M + H)+. Anal. Calcd for C19H20N4O · 0.40 H2O: C, 69.66; H, 6.40; N, 17.10. Found: C, 69.99; H, 6.27; N, 16.84.
 

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