
 CHEMBL325322

 30 31  0  0  0  0  0  0  0  0999 V2000
    1.5196   -0.0667   -0.6826 C   0  0  0  0  0
    2.5994    0.5167    0.1770 C   0  0  0  0  0
    2.4073    1.3297    1.0692 O   0  0  0  0  0
    3.8072    0.0096   -0.1914 O   0  0  0  0  0
    4.9534    0.5145    0.5206 C   0  0  0  0  0
    6.0791   -0.5273    0.4142 C   0  0  0  0  0
    7.4884    0.0451    0.6690 C   0  0  0  0  0
    7.4160    1.4122    1.3372 C   0  0  0  0  0
    6.8393    2.2291    0.1846 C   0  0  0  0  0
    5.3455    1.9079    0.0015 C   0  0  0  0  0
    7.5406    1.7151   -1.0154 N   0  0  0  0  0
    8.1654    0.4330   -0.6473 C   0  0  0  0  0
    8.5239    2.6611   -1.5322 C   0  0  0  0  0
    1.6867    0.2129   -1.7255 H   0  0  0  0  0
    0.5509    0.3294   -0.3657 H   0  0  0  0  0
    1.5035   -1.1536   -0.5727 H   0  0  0  0  0
    4.6976    0.5954    1.5867 H   0  0  0  0  0
    6.0356   -1.0498   -0.5499 H   0  0  0  0  0
    5.8771   -1.3074    1.1608 H   0  0  0  0  0
    8.0994   -0.6685    1.2308 H   0  0  0  0  0
    6.8008    1.4268    2.2421 H   0  0  0  0  0
    8.4191    1.7676    1.6050 H   0  0  0  0  0
    6.9718    3.3074    0.3279 H   0  0  0  0  0
    4.7593    2.6533    0.5552 H   0  0  0  0  0
    5.0397    2.0359   -1.0456 H   0  0  0  0  0
    9.2443    0.5416   -0.4732 H   0  0  0  0  0
    8.0276   -0.3137   -1.4356 H   0  0  0  0  0
    8.0310    3.5860   -1.8511 H   0  0  0  0  0
    9.0248    2.2484   -2.4147 H   0  0  0  0  0
    9.2868    2.9169   -0.7881 H   0  0  0  0  0
  1  2  1  0  0  0
  1 14  1  0  0  0
  1 15  1  0  0  0
  1 16  1  0  0  0
  2  4  1  0  0  0
  2  3  2  0  0  0
  4  5  1  0  0  0
  5 10  1  0  0  0
  5  6  1  0  0  0
  5 17  1  0  0  0
  6  7  1  0  0  0
  6 18  1  0  0  0
  6 19  1  0  0  0
  7 12  1  0  0  0
  7  8  1  0  0  0
  7 20  1  0  0  0
  8  9  1  0  0  0
  8 21  1  0  0  0
  8 22  1  0  0  0
  9 10  1  0  0  0
  9 11  1  0  0  0
  9 23  1  0  0  0
 10 24  1  0  0  0
 10 25  1  0  0  0
 11 12  1  0  0  0
 11 13  1  0  0  0
 12 26  1  0  0  0
 12 27  1  0  0  0
 13 28  1  0  0  0
 13 29  1  0  0  0
 13 30  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL325322

>  <PubChem CID>
44337638

>  <Formula>
C10H17NO2

>  <Molecular Weight>
183.251000

>  <IUPAC Name>
[(3R)-6-methyl-6-azabicyclo[3.2.1]octan-3-yl] acetate

>  <XlogP>
1.2

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CC(=O)OC1CC2CC(C1)N(C2)C

>  <Isomeric SMILES>
CC(=O)O[C@@H]1CC2CC(C1)N(C2)C

>  <InChI Std. ID>
InChI=1S/C10H17NO2/c1-7(12)13-10-4-8-3-9(5-10)11(2)6-8/h8-10H,3-6H2,1-2H3/t8?,9?,10-/m1/s1

>  <InChI Key>
FSBJEHDHWKZHJV-UDNWOFFPSA-N

