-ISIS-  08091621332D

 13 13  0  0  0  0  0  0  0  0999 V2000
   -0.8583   -0.4917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7333   -0.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5958   -0.5042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8458   -1.4917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0083    0.0125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4583    0.0583    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7333    0.0333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4500   -0.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8792   -0.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6042   -0.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7333    1.0083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4625    0.9958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6083    1.4958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  1  2  0  0  0  0
  5  1  1  0  0  0  0
  6 10  1  0  0  0  0
  7  9  1  0  0  0  0
  8  3  1  0  0  0  0
  9  5  1  0  0  0  0
 10  7  1  0  0  0  0
 11  2  1  0  0  0  0
 12 13  1  0  0  0  0
 13 11  2  0  0  0  0
  8 12  2  0  0  0  0
M  END
>  <ID> (BBL000589)
BBL000589

>  <SALTDATA> (BBL000589)
HCl

>  <Rotatable_Bonds> (BBL000589)
4

>  <logP> (BBL000589)
-0.576

>  <PSA> (BBL000589)
68.01

>  <H_Donors> (BBL000589)
3

>  <H_Acceptors> (BBL000589)
1

>  <Number_of_rings> (BBL000589)
1

>  <NAME> (BBL000589)
N-(3-aminopropyl)pyridine-2-carboxamide

>  <Mol_Weight> (BBL000589)
179.22

>  <Mol_Formula> (BBL000589)
C9H13N3O

>  <Smiles> (BBL000589)
NCCCNC(=O)c1ccccn1

>  <CAS_Number> (BBL000589)
799250-34-3

>  <Alternative_identifier> (BBL000589)
MFCD06010261

$$$$