
 BDBM50002141

 33 35  0  0  0  0  0  0  0  0999 V2000
    0.7296    0.2656   -0.0824 C   0  0  0  0  0
    2.2356    0.0668   -0.1753 C   0  0  0  0  0
    2.6966   -1.2278    0.5367 C   0  0  0  0  0
    3.5265   -0.8395    1.7217 N   0  0  0  0  0
    3.6002    0.4653    1.6327 C   0  0  0  0  0
    2.9389    1.0642    0.5898 N   0  0  0  0  0
    3.1318    2.3921    0.3321 C   0  0  0  0  0
    3.9120    3.1307    1.1364 C   0  0  0  0  0
    4.5479    2.6521    2.2621 N   0  0  0  0  0
    4.4252    1.3787    2.5869 C   0  0  0  0  0
    5.0316    0.9071    3.7559 N   0  0  0  0  0
    4.9413   -0.4825    4.2196 C   0  0  0  0  0
    6.1376   -1.2979    3.6811 C   0  0  0  0  0
    7.4486   -0.7196    4.0719 N   0  0  0  0  0
    7.4905    0.7063    3.6667 C   0  0  0  0  0
    6.2935    1.5344    4.1925 C   0  0  0  0  0
    0.2010   -0.5439   -0.5961 H   0  0  0  0  0
    0.4315    1.2119   -0.5464 H   0  0  0  0  0
    0.3892    0.2882    0.9591 H   0  0  0  0  0
    2.5559    0.0606   -1.2234 H   0  0  0  0  0
    3.3172   -1.8307   -0.1359 H   0  0  0  0  0
    1.8556   -1.8466    0.8669 H   0  0  0  0  0
    2.6384    2.7972   -0.5431 H   0  0  0  0  0
    4.0656    4.1849    0.9255 H   0  0  0  0  0
    3.9822   -0.9498    3.9892 H   0  0  0  0  0
    4.9863   -0.4805    5.3174 H   0  0  0  0  0
    6.0828   -2.3207    4.0693 H   0  0  0  0  0
    6.0973   -1.3676    2.5882 H   0  0  0  0  0
    7.5166   -0.7591    5.0889 H   0  0  0  0  0
    8.4234    1.1440    4.0383 H   0  0  0  0  0
    7.5278    0.7603    2.5717 H   0  0  0  0  0
    6.3174    1.5607    5.2893 H   0  0  0  0  0
    6.3862    2.5731    3.8582 H   0  0  0  0  0
  1  2  1  0  0  0
  1 17  1  0  0  0
  1 18  1  0  0  0
  1 19  1  0  0  0
  2  3  1  0  0  0
  2  6  1  0  0  0
  2 20  1  0  0  0
  3  4  1  0  0  0
  3 21  1  0  0  0
  3 22  1  0  0  0
  4  5  2  0  0  0
  5  6  1  0  0  0
  5 10  1  0  0  0
  6  7  1  0  0  0
  7  8  2  0  0  0
  7 23  1  0  0  0
  8  9  1  0  0  0
  8 24  1  0  0  0
  9 10  2  0  0  0
 10 11  1  0  0  0
 11 16  1  0  0  0
 11 12  1  0  0  0
 12 13  1  0  0  0
 12 25  1  0  0  0
 12 26  1  0  0  0
 13 14  1  0  0  0
 13 27  1  0  0  0
 13 28  1  0  0  0
 14 15  1  0  0  0
 14 29  1  0  0  0
 15 16  1  0  0  0
 15 30  1  0  0  0
 15 31  1  0  0  0
 16 32  1  0  0  0
 16 33  1  0  0  0
M  END

>  <Chemical Name>
BDBM50002141

>  <PubChem CID>
10013705

>  <Formula>
C11H17N5

>  <Molecular Weight>
219.292000

>  <IUPAC Name>
3-methyl-8-piperazin-1-yl-2,3-dihydroimidazo[1,2-a]pyrazine

>  <XlogP>
-1.1

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CC1CN=C2N1C=CN=C2N3CCNCC3

>  <Isomeric SMILES>
CC1CN=C2N1C=CN=C2N3CCNCC3

>  <InChI Std. ID>
InChI=1S/C11H17N5/c1-9-8-14-11-10(13-4-7-16(9)11)15-5-2-12-3-6-15/h4,7,9,12H,2-3,5-6,8H2,1H3

>  <InChI Key>
FNXRPSLJPVZLGZ-UHFFFAOYSA-N

