
 7-Methyl-[1,8]naphthyridin-4-ylamine

 21 22  0  0  0  0  0  0  0  0999 V2000
    0.9726   -0.1056   -0.0502 C   0  0  0  0  0
    2.4638    0.0300    0.0100 C   0  0  0  0  0
    3.1711   -1.1200    0.0899 N   0  0  0  0  0
    4.5036   -1.0820    0.1580 C   0  0  0  0  0
    5.1373   -2.2531    0.2007 N   0  0  0  0  0
    6.4830   -2.2661    0.2208 C   0  0  0  0  0
    7.2613   -1.1294    0.2385 C   0  0  0  0  0
    6.6229    0.1052    0.2773 C   0  0  0  0  0
    5.2084    0.1397    0.1726 C   0  0  0  0  0
    4.4523    1.3275    0.0853 C   0  0  0  0  0
    3.0673    1.2739    0.0084 C   0  0  0  0  0
    7.4162    1.2699    0.1994 N   0  0  0  0  0
    0.4914    0.8390   -0.3225 H   0  0  0  0  0
    0.5898   -0.4223    0.9247 H   0  0  0  0  0
    0.6945   -0.8527   -0.8002 H   0  0  0  0  0
    6.9336   -3.2545    0.2144 H   0  0  0  0  0
    8.3417   -1.2131    0.2312 H   0  0  0  0  0
    4.9353    2.2990    0.0663 H   0  0  0  0  0
    2.4828    2.1853   -0.0562 H   0  0  0  0  0
    8.3600    1.1447    0.5546 H   0  0  0  0  0
    6.9797    2.0914    0.6043 H   0  0  0  0  0
  1  2  1  0  0  0
  1 13  1  0  0  0
  1 14  1  0  0  0
  1 15  1  0  0  0
  2 11  1  0  0  0
  2  3  2  0  0  0
  3  4  1  0  0  0
  4  9  1  0  0  0
  4  5  2  0  0  0
  5  6  1  0  0  0
  6  7  2  0  0  0
  6 16  1  0  0  0
  7  8  1  0  0  0
  7 17  1  0  0  0
  8  9  2  0  0  0
  8 12  1  0  0  0
  9 10  1  0  0  0
 10 11  2  0  0  0
 10 18  1  0  0  0
 11 19  1  0  0  0
 12 20  1  0  0  0
 12 21  1  0  0  0
M  END

>  <Chemical Name>
7-Methyl-[1,8]naphthyridin-4-ylamine

>  <PubChem CID>
12455201

>  <Formula>
C9H9N3

>  <Molecular Weight>
159.192000

>  <IUPAC Name>
7-methyl-1,8-naphthyridin-4-amine

>  <XlogP>
1.2

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CC1=NC2=NC=CC(=C2C=C1)N

>  <Isomeric SMILES>
CC1=NC2=NC=CC(=C2C=C1)N

>  <InChI Std. ID>
InChI=1S/C9H9N3/c1-6-2-3-7-8(10)4-5-11-9(7)12-6/h2-5H,1H3,(H2,10,11,12)

>  <InChI Key>
BURICQOPQKPYBQ-UHFFFAOYSA-N

