
 CHEMBL99291

 44 45  0  0  0  0  0  0  0  0999 V2000
    4.7433   -1.0854   -1.6763 C   0  0  0  0  0
    4.8602   -0.9129   -0.1682 C   0  0  0  0  0
    5.2712    0.5137    0.2339 C   0  0  0  0  0
    4.3365    1.5811   -0.1855 N   0  0  0  0  0
    3.0038    1.4233    0.4347 C   0  0  0  0  0
    2.9370    1.6224    1.9570 C   0  0  0  0  0
    1.5176    1.4420    2.4795 C   0  0  0  0  0
    4.9245    2.9501   -0.0455 C   0  0  0  0  0
    3.9565    4.0662   -0.5145 C   0  0  0  0  0
    4.5403    5.4582   -0.2727 C   0  0  0  0  0
    5.9118    5.5879   -0.7231 N   0  0  0  0  0
    6.7212    4.5142   -0.9928 C   0  0  0  0  0
    7.9424    5.0051   -1.4065 C   0  0  0  0  0
    7.8749    6.4150   -1.3424 C   0  0  0  0  0
    6.6132    6.7600   -0.8922 C   0  0  0  0  0
    6.0445    8.1050   -0.6205 C   0  0  0  0  0
    5.2975    8.4739   -1.7668 O   0  0  0  0  0
    6.2453    3.1019   -0.8602 C   0  0  0  0  0
    4.4870   -2.1220   -1.9196 H   0  0  0  0  0
    5.6919   -0.8487   -2.1709 H   0  0  0  0  0
    3.9660   -0.4390   -2.0982 H   0  0  0  0  0
    5.6256   -1.6064    0.1998 H   0  0  0  0  0
    3.9266   -1.2131    0.3157 H   0  0  0  0  0
    6.2507    0.6610   -0.2306 H   0  0  0  0  0
    5.4448    0.5522    1.3153 H   0  0  0  0  0
    2.6001    0.4347    0.1897 H   0  0  0  0  0
    2.2904    2.0957   -0.0535 H   0  0  0  0  0
    3.2817    2.6257    2.2316 H   0  0  0  0  0
    3.5837    0.9025    2.4700 H   0  0  0  0  0
    0.8326    2.1535    2.0092 H   0  0  0  0  0
    1.4899    1.6069    3.5604 H   0  0  0  0  0
    1.1541    0.4288    2.2812 H   0  0  0  0  0
    5.1619    3.1290    1.0126 H   0  0  0  0  0
    3.0001    4.0328    0.0167 H   0  0  0  0  0
    3.7388    3.9366   -1.5828 H   0  0  0  0  0
    4.5410    5.6895    0.7985 H   0  0  0  0  0
    3.9359    6.2070   -0.7947 H   0  0  0  0  0
    8.7918    4.4097   -1.7144 H   0  0  0  0  0
    8.6699    7.1090   -1.5873 H   0  0  0  0  0
    6.8312    8.8469   -0.4553 H   0  0  0  0  0
    5.3844    8.1073    0.2506 H   0  0  0  0  0
    5.8857    8.3371   -2.5305 H   0  0  0  0  0
    6.1105    2.6890   -1.8688 H   0  0  0  0  0
    7.0500    2.5379   -0.3761 H   0  0  0  0  0
  1  2  1  0  0  0
  1 19  1  0  0  0
  1 20  1  0  0  0
  1 21  1  0  0  0
  2  3  1  0  0  0
  2 22  1  0  0  0
  2 23  1  0  0  0
  3  4  1  0  0  0
  3 24  1  0  0  0
  3 25  1  0  0  0
  4  8  1  0  0  0
  4  5  1  0  0  0
  5  6  1  0  0  0
  5 26  1  0  0  0
  5 27  1  0  0  0
  6  7  1  0  0  0
  6 28  1  0  0  0
  6 29  1  0  0  0
  7 30  1  0  0  0
  7 31  1  0  0  0
  7 32  1  0  0  0
  8  9  1  0  0  0
  8 18  1  0  0  0
  8 33  1  0  0  0
  9 10  1  0  0  0
  9 34  1  0  0  0
  9 35  1  0  0  0
 10 11  1  0  0  0
 10 36  1  0  0  0
 10 37  1  0  0  0
 11 15  1  0  0  0
 11 12  1  0  0  0
 12 13  2  0  0  0
 12 18  1  0  0  0
 13 14  1  0  0  0
 13 38  1  0  0  0
 14 15  2  0  0  0
 14 39  1  0  0  0
 15 16  1  0  0  0
 16 17  1  0  0  0
 16 40  1  0  0  0
 16 41  1  0  0  0
 17 42  1  0  0  0
 18 43  1  0  0  0
 18 44  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL99291

>  <PubChem CID>
44329299

>  <Formula>
C15H26N2O

>  <Molecular Weight>
250.386000

>  <IUPAC Name>
[(7R)-7-(dipropylamino)-5,6,7,8-tetrahydroindolizin-3-yl]methanol

>  <XlogP>
2.1

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
CCCN(CCC)C1CCN2C(=CC=C2CO)C1

>  <Isomeric SMILES>
CCCN(CCC)[C@@H]1CCN2C(=CC=C2CO)C1

>  <InChI Std. ID>
InChI=1S/C15H26N2O/c1-3-8-16(9-4-2)13-7-10-17-14(11-13)5-6-15(17)12-18/h5-6,13,18H,3-4,7-12H2,1-2H3/t13-/m1/s1

>  <InChI Key>
FFZALGRQJRVCKO-CYBMUJFWSA-N

