4-Amino-N-(1-methylethyl)benzamide

Synthesis of compound 178.1. To a solution of 177.1 (0.6g, 4.37mmol, l .Oeq) in DMF (6 mL) were added isopropyl amine (0.73 mLl, 8.75 mmol, 2.0 eq), HATU (2.49 g, 6.55 mmol, 1.5 eq). Reaction mixture was cooled to 0 °C. DIPEA (1.4 ml, 8.74 mmol, 2.0 eq) was added at 0 °C. Reaction mixture was stirred at room temperature for 2 hours. Upon reaction completion, mixture was poured into water and product was extracted with EtOAC. Organic layers were combined, dried over sodium sulphate and concentrated under reduced pressure to obtain crude which was purified to get pure 178.1 (0.30 g, 38.5 percent). MS (ES): m/z 176.2 [M+H]

Molecular Weight:178.23
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:178.110613074
Monoisotopic Mass:178.110613074
Topological Polar Surface Area:55.1
Heavy Atom Count:13
Complexity:172
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes