
 76149-15-0

 42 43  0  0  0  0  0  0  0  0999 V2000
    0.8022   -0.0493   -0.0106 C   0  0  0  0  0
    2.2982   -0.1023   -0.2886 C   0  0  0  0  0
    2.9224    1.2993   -0.2327 C   0  0  0  0  0
    4.3804    1.3429   -0.4738 N   0  0  0  0  0
    4.7869    0.7298   -1.7509 C   0  0  0  0  0
    4.2406    1.3927   -3.0227 C   0  0  0  0  0
    4.7242    0.6760   -4.2748 C   0  0  0  0  0
    4.8538    2.7395   -0.3048 C   0  0  0  0  0
    6.3694    2.9527   -0.4823 C   0  0  0  0  0
    6.7722    4.4030   -0.3001 C   0  0  0  0  0
    6.4919    5.4094   -1.2599 C   0  0  0  0  0
    5.8298    5.4183   -2.5245 C   0  0  0  0  0
    5.8509    6.7038   -3.0120 C   0  0  0  0  0
    6.5127    7.4802   -2.1012 N   0  0  0  0  0
    6.9144    6.7197   -1.0261 C   0  0  0  0  0
    7.6211    7.0947    0.1201 C   0  0  0  0  0
    7.8961    6.1013    1.0602 C   0  0  0  0  0
    7.4791    4.7858    0.8588 C   0  0  0  0  0
    0.3726   -1.0550   -0.0582 H   0  0  0  0  0
    0.2908    0.5702   -0.7560 H   0  0  0  0  0
    0.5981    0.3644    0.9809 H   0  0  0  0  0
    2.4339   -0.5553   -1.2760 H   0  0  0  0  0
    2.7816   -0.7574    0.4455 H   0  0  0  0  0
    2.7291    1.6995    0.7717 H   0  0  0  0  0
    2.3958    1.9584   -0.9343 H   0  0  0  0  0
    4.5099   -0.3309   -1.7480 H   0  0  0  0  0
    5.8817    0.6953   -1.8010 H   0  0  0  0  0
    4.5646    2.4356   -3.0772 H   0  0  0  0  0
    3.1458    1.3913   -3.0225 H   0  0  0  0  0
    5.8175    0.6421   -4.3117 H   0  0  0  0  0
    4.3703    1.2003   -5.1681 H   0  0  0  0  0
    4.3434   -0.3490   -4.3085 H   0  0  0  0  0
    4.5970    3.0651    0.7130 H   0  0  0  0  0
    4.3024    3.4043   -0.9808 H   0  0  0  0  0
    6.6970    2.6568   -1.4849 H   0  0  0  0  0
    6.9166    2.3159    0.2241 H   0  0  0  0  0
    5.3814    4.5719   -3.0240 H   0  0  0  0  0
    5.4566    7.1271   -3.9258 H   0  0  0  0  0
    6.6864    8.4705   -2.1975 H   0  0  0  0  0
    7.9481    8.1169    0.2778 H   0  0  0  0  0
    8.4475    6.3574    1.9623 H   0  0  0  0  0
    7.7179    4.0415    1.6167 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 33  1  0  0  0
  8 34  1  0  0  0
  9 10  1  0  0  0
  9 35  1  0  0  0
  9 36  1  0  0  0
 10 18  1  0  0  0
 10 11  2  0  0  0
 11 12  1  0  0  0
 11 15  1  0  0  0
 12 13  2  0  0  0
 12 37  1  0  0  0
 13 14  1  0  0  0
 13 38  1  0  0  0
 14 15  1  0  0  0
 14 39  1  0  0  0
 15 16  2  0  0  0
 16 17  1  0  0  0
 16 40  1  0  0  0
 17 18  2  0  0  0
 17 41  1  0  0  0
 18 42  1  0  0  0
M  END

>  <Chemical Name>
76149-15-0

>  <PubChem CID>
3086054

>  <Formula>
C16H24N2

>  <Molecular Weight>
244.382000

>  <IUPAC Name>
N-[2-(1H-indol-4-yl)ethyl]-N-propylpropan-1-amine

>  <XlogP>
4.1

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
1

>  <Canonical SMILES>
CCCN(CCC)CCC1=C2C=CNC2=CC=C1

>  <Isomeric SMILES>
CCCN(CCC)CCC1=C2C=CNC2=CC=C1

>  <InChI Std. ID>
InChI=1S/C16H24N2/c1-3-11-18(12-4-2)13-9-14-6-5-7-16-15(14)8-10-17-16/h5-8,10,17H,3-4,9,11-13H2,1-2H3

>  <InChI Key>
AFRBPRLOPBAGCM-UHFFFAOYSA-N

