Molecule Editor

Molecule ID: FYI-1016256 Edit

Molecule Structure InChIKey: XBPCUCUWBYBCDP-UHFFFAOYSA-N

Molecule Structure SMILES String: C2CCC(NC1CCCCC1)CC2

Download SDF Download SVG Structure in 2D SDF:

FYI-1016256
FYIcenter.com

 13 14  0  0  0  0  0  0  0  0999 V2000
    4.8498    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  6  1  1  0  0  0  0
  7  1  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 13  8  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016256-3D
FYIcenter.com

 36 37  0     0  0  0  0  0  0999 V2000
   -0.0002    1.1469   -0.0017 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1850    0.3019   -0.2931 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1841    0.3015    0.2907 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4786   -0.5839    0.9183 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3736    1.2042   -0.6270 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4809   -0.5815   -0.9219 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3716    1.2032    0.6298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7575   -1.3938    0.7208 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6521    0.3933   -0.8235 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7595   -1.3917   -0.7231 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6498    0.3921    0.8278 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9447   -0.4969    0.3812 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9457   -0.4953   -0.3783 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0275   -0.3150   -1.1834 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0248   -0.3138    1.1814 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5761    0.0254    1.8265 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6886   -1.3187    1.0995 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1689    1.7826   -1.5365 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5351    1.9310    0.1803 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5820    0.0285   -1.8292 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6912   -1.3156   -1.1069 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1628    1.7796    1.5395 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5372    1.9319   -0.1750 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1941    1.7397   -0.8089 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9770   -1.9660    1.6295 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6083   -2.1215   -0.0867 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5556   -0.2288   -1.7219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4960    1.0711   -0.9942 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9814   -1.9617   -1.6324 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6083   -2.1212    0.0824 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5510   -0.2321    1.7246 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4932    1.0698    1.0023 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8270   -1.1141    0.1781 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1863    0.1309    1.2478 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8277   -1.1128   -0.1743 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1894    0.1346   -1.2427 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1 24  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2 14  1  0  0  0  0
  3  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3 15  1  0  0  0  0
  4  8  1  0  0  0  0
  4 16  1  0  0  0  0
  4 17  1  0  0  0  0
  5  9  1  0  0  0  0
  5 18  1  0  0  0  0
  5 19  1  0  0  0  0
  6 10  1  0  0  0  0
  6 20  1  0  0  0  0
  6 21  1  0  0  0  0
  7 11  1  0  0  0  0
  7 22  1  0  0  0  0
  7 23  1  0  0  0  0
  8 12  1  0  0  0  0
  8 25  1  0  0  0  0
  8 26  1  0  0  0  0
  9 12  1  0  0  0  0
  9 27  1  0  0  0  0
  9 28  1  0  0  0  0
 10 13  1  0  0  0  0
 10 29  1  0  0  0  0
 10 30  1  0  0  0  0
 11 13  1  0  0  0  0
 11 31  1  0  0  0  0
 11 32  1  0  0  0  0
 12 33  1  0  0  0  0
 12 34  1  0  0  0  0
 13 35  1  0  0  0  0
 13 36  1  0  0  0  0
M  END
$$$$