
 76537-53-6

 28 30  0  0  0  0  0  0  0  0999 V2000
    0.4987    1.2630   -0.3290 C   0  0  0  0  0
   -0.8195    1.1990    0.4769 C   0  0  0  0  0
   -1.5420   -0.0419    0.1461 N   0  0  0  0  0
   -0.7099   -1.2235    0.4517 C   0  0  0  0  0
    0.6108   -1.1533   -0.3490 C   0  0  0  0  0
    1.3788    0.0913   -0.1033 N   0  0  0  0  0
   -2.4313   -0.0995   -0.9404 C   0  0  0  0  0
   -2.6054   -1.2730   -1.5302 N   0  0  0  0  0
   -3.4667   -1.3971   -2.6013 C   0  0  0  0  0
   -4.1799   -0.3856   -3.1133 C   0  0  0  0  0
   -4.0406    0.8539   -2.5307 N   0  0  0  0  0
   -3.1947    1.0439   -1.4649 C   0  0  0  0  0
   -3.2132    2.2981   -1.0538 N   0  0  0  0  0
   -4.1013    2.9328   -1.8864 C   0  0  0  0  0
   -4.6241    2.0583   -2.8120 C   0  0  0  0  0
    0.2800    1.3414   -1.4009 H   0  0  0  0  0
    1.0503    2.1672   -0.0494 H   0  0  0  0  0
   -1.4043    2.1041    0.3175 H   0  0  0  0  0
   -0.5852    1.1916    1.5497 H   0  0  0  0  0
   -0.4853   -1.2287    1.5262 H   0  0  0  0  0
   -1.2328   -2.1650    0.2515 H   0  0  0  0  0
    1.2417   -2.0076   -0.0803 H   0  0  0  0  0
    0.4055   -1.2351   -1.4231 H   0  0  0  0  0
    1.6635    0.0965    0.8763 H   0  0  0  0  0
   -3.5443   -2.3946   -3.0269 H   0  0  0  0  0
   -4.8553   -0.4887   -3.9513 H   0  0  0  0  0
   -4.3188    3.9875   -1.7751 H   0  0  0  0  0
   -5.3379    2.1861   -3.6124 H   0  0  0  0  0
  1  6  1  0  0  0
  1  2  1  0  0  0
  1 16  1  0  0  0
  1 17  1  0  0  0
  2  3  1  0  0  0
  2 18  1  0  0  0
  2 19  1  0  0  0
  3  4  1  0  0  0
  3  7  1  0  0  0
  4  5  1  0  0  0
  4 20  1  0  0  0
  4 21  1  0  0  0
  5  6  1  0  0  0
  5 22  1  0  0  0
  5 23  1  0  0  0
  6 24  1  0  0  0
  7  8  2  0  0  0
  7 12  1  0  0  0
  8  9  1  0  0  0
  9 10  2  0  0  0
  9 25  1  0  0  0
 10 11  1  0  0  0
 10 26  1  0  0  0
 11 12  1  0  0  0
 11 15  1  0  0  0
 12 13  2  0  0  0
 13 14  1  0  0  0
 14 15  2  0  0  0
 14 27  1  0  0  0
 15 28  1  0  0  0
M  END

>  <Chemical Name>
76537-53-6

>  <PubChem CID>
131268

>  <Formula>
C10H13N5

>  <Molecular Weight>
203.249000

>  <IUPAC Name>
8-piperazin-1-ylimidazo[1,2-a]pyrazine

>  <XlogP>
0.5

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C1CN(CCN1)C2=NC=CN3C2=NC=C3

>  <Isomeric SMILES>
C1CN(CCN1)C2=NC=CN3C2=NC=C3

>  <InChI Std. ID>
InChI=1S/C10H13N5/c1-5-14(6-2-11-1)9-10-13-4-8-15(10)7-3-12-9/h3-4,7-8,11H,1-2,5-6H2

>  <InChI Key>
NSHLOJVJEGEMSF-UHFFFAOYSA-N

