
 CHEMBL387725

 44 46  0  0  0  0  0  0  0  0999 V2000
   -0.5099   -2.2635    1.1858 C   0  0  0  0  0
   -1.2737   -1.2102    1.9669 C   0  0  0  0  0
   -0.8978    0.0804    1.3694 N   0  0  0  0  0
    0.5390   -0.0729    1.0499 C   0  0  0  0  0
    0.7925   -1.5708    0.7957 C   0  0  0  0  0
    1.1544   -1.8807   -0.5790 N   0  0  0  0  0
    2.4548   -1.7669   -1.0276 C   0  0  0  0  0
    3.3865   -1.4110   -0.3098 O   0  0  0  0  0
    2.6390   -2.1580   -2.4830 C   0  0  0  0  0
    2.6017   -0.9812   -3.4229 C   0  0  0  0  0
    1.3913   -0.5454   -3.9795 C   0  0  0  0  0
    1.3673    0.5429   -4.8533 C   0  0  0  0  0
    2.5500    1.2042   -5.1785 C   0  0  0  0  0
    3.7573    0.7835   -4.6251 C   0  0  0  0  0
    3.7831   -0.3005   -3.7463 C   0  0  0  0  0
   -1.6697    0.4090    0.1590 C   0  0  0  0  0
   -3.1440    0.6430    0.4208 C   0  0  0  0  0
   -4.1163   -0.1024   -0.2637 C   0  0  0  0  0
   -5.4752    0.1242   -0.0369 C   0  0  0  0  0
   -5.8781    1.0993    0.8733 C   0  0  0  0  0
   -4.9231    1.8485    1.5587 C   0  0  0  0  0
   -3.5637    1.6228    1.3330 C   0  0  0  0  0
   -0.3247   -3.1595    1.7865 H   0  0  0  0  0
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    1.1054    0.2332    1.9389 H   0  0  0  0  0
    1.6051   -1.9119    1.4489 H   0  0  0  0  0
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    1.8749   -2.8907   -2.7710 H   0  0  0  0  0
    3.5952   -2.6891   -2.5734 H   0  0  0  0  0
    0.4591   -1.0530   -3.7474 H   0  0  0  0  0
    0.4261    0.8745   -5.2846 H   0  0  0  0  0
    2.5316    2.0490   -5.8623 H   0  0  0  0  0
    4.6802    1.2997   -4.8756 H   0  0  0  0  0
    4.7333   -0.6127   -3.3159 H   0  0  0  0  0
   -1.5446   -0.3580   -0.6157 H   0  0  0  0  0
   -1.2822    1.3424   -0.2714 H   0  0  0  0  0
   -3.8215   -0.8673   -0.9782 H   0  0  0  0  0
   -6.2198   -0.4591   -0.5707 H   0  0  0  0  0
   -6.9355    1.2759    1.0497 H   0  0  0  0  0
   -5.2353    2.6079    2.2700 H   0  0  0  0  0
   -2.8250    2.2085    1.8763 H   0  0  0  0  0
  1  5  1  0  0  0
  1  2  1  0  0  0
  1 23  1  0  0  0
  1 24  1  0  0  0
  2  3  1  0  0  0
  2 25  1  0  0  0
  2 26  1  0  0  0
  3  4  1  0  0  0
  3 16  1  0  0  0
  4  5  1  0  0  0
  4 27  1  0  0  0
  4 28  1  0  0  0
  5  6  1  0  0  0
  5 29  1  0  0  0
  6  7  1  0  0  0
  6 30  1  0  0  0
  7  9  1  0  0  0
  7  8  2  0  0  0
  9 10  1  0  0  0
  9 31  1  0  0  0
  9 32  1  0  0  0
 10 11  2  0  0  0
 10 15  1  0  0  0
 11 12  1  0  0  0
 11 33  1  0  0  0
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 13 14  1  0  0  0
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 14 15  2  0  0  0
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 15 37  1  0  0  0
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 16 39  1  0  0  0
 17 18  2  0  0  0
 17 22  1  0  0  0
 18 19  1  0  0  0
 18 40  1  0  0  0
 19 20  2  0  0  0
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 22 44  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL387725

>  <PubChem CID>
11269801

>  <Formula>
C19H22N2O

>  <Molecular Weight>
294.398000

>  <IUPAC Name>
N-(1-benzylpyrrolidin-3-yl)-2-phenylacetamide

>  <XlogP>
2.9

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
C1CN(CC1NC(=O)CC2=CC=CC=C2)CC3=CC=CC=C3

>  <Isomeric SMILES>
C1CN(CC1NC(=O)CC2=CC=CC=C2)CC3=CC=CC=C3

>  <InChI Std. ID>
InChI=1S/C19H22N2O/c22-19(13-16-7-3-1-4-8-16)20-18-11-12-21(15-18)14-17-9-5-2-6-10-17/h1-10,18H,11-15H2,(H,20,22)

>  <InChI Key>
HMWGXCXCANZRTB-UHFFFAOYSA-N

