
 2-Dipropylamino-indan-5-ol

 40 41  0  0  0  0  0  0  0  0999 V2000
    0.7781    0.5323   -0.5057 C   0  0  0  0  0
    2.2902    0.3681   -0.5702 C   0  0  0  0  0
    3.0111    1.7024   -0.3221 C   0  0  0  0  0
    4.4836    1.6009   -0.3113 N   0  0  0  0  0
    5.0431    1.0096   -1.5438 C   0  0  0  0  0
    4.7476    1.7628   -2.8490 C   0  0  0  0  0
    5.3657    1.0550   -4.0460 C   0  0  0  0  0
    5.1248    2.8916    0.0461 C   0  0  0  0  0
    4.6731    3.4934    1.4111 C   0  0  0  0  0
    5.8411    4.3599    1.7747 C   0  0  0  0  0
    6.9805    3.9737    1.0646 C   0  0  0  0  0
    6.6769    2.8228    0.1579 C   0  0  0  0  0
    8.2019    4.5891    1.2804 C   0  0  0  0  0
    8.2577    5.6164    2.2174 C   0  0  0  0  0
    7.1202    6.0179    2.9299 C   0  0  0  0  0
    5.8957    5.3783    2.7128 C   0  0  0  0  0
    9.4675    6.2138    2.4258 O   0  0  0  0  0
    0.2869   -0.4327   -0.6659 H   0  0  0  0  0
    0.4288    1.2227   -1.2804 H   0  0  0  0  0
    0.4630    0.9177    0.4688 H   0  0  0  0  0
    2.5373   -0.0375   -1.5566 H   0  0  0  0  0
    2.6044   -0.3689    0.1785 H   0  0  0  0  0
    2.6703    2.0585    0.6570 H   0  0  0  0  0
    2.6783    2.4469   -1.0554 H   0  0  0  0  0
    4.6929   -0.0255   -1.6351 H   0  0  0  0  0
    6.1284    0.8949   -1.4356 H   0  0  0  0  0
    5.1459    2.7820   -2.8043 H   0  0  0  0  0
    3.6681    1.8402   -3.0163 H   0  0  0  0  0
    6.4523    0.9789   -3.9395 H   0  0  0  0  0
    5.1524    1.6106   -4.9646 H   0  0  0  0  0
    4.9575    0.0455   -4.1577 H   0  0  0  0  0
    4.8808    3.6401   -0.7236 H   0  0  0  0  0
    4.5411    2.7183    2.1743 H   0  0  0  0  0
    3.7532    4.0772    1.3053 H   0  0  0  0  0
    7.0100    1.8912    0.6295 H   0  0  0  0  0
    7.1542    2.9407   -0.8198 H   0  0  0  0  0
    9.0933    4.2793    0.7461 H   0  0  0  0  0
    7.1749    6.8179    3.6616 H   0  0  0  0  0
    5.0133    5.6712    3.2728 H   0  0  0  0  0
    9.3651    6.8782    3.1261 H   0  0  0  0  0
  1  2  1  0  0  0
  1 18  1  0  0  0
  1 19  1  0  0  0
  1 20  1  0  0  0
  2  3  1  0  0  0
  2 21  1  0  0  0
  2 22  1  0  0  0
  3  4  1  0  0  0
  3 23  1  0  0  0
  3 24  1  0  0  0
  4  8  1  0  0  0
  4  5  1  0  0  0
  5  6  1  0  0  0
  5 25  1  0  0  0
  5 26  1  0  0  0
  6  7  1  0  0  0
  6 27  1  0  0  0
  6 28  1  0  0  0
  7 29  1  0  0  0
  7 30  1  0  0  0
  7 31  1  0  0  0
  8 12  1  0  0  0
  8  9  1  0  0  0
  8 32  1  0  0  0
  9 10  1  0  0  0
  9 33  1  0  0  0
  9 34  1  0  0  0
 10 11  2  0  0  0
 10 16  1  0  0  0
 11 13  1  0  0  0
 11 12  1  0  0  0
 12 35  1  0  0  0
 12 36  1  0  0  0
 13 14  2  0  0  0
 13 37  1  0  0  0
 14 15  1  0  0  0
 14 17  1  0  0  0
 15 16  2  0  0  0
 15 38  1  0  0  0
 16 39  1  0  0  0
 17 40  1  0  0  0
M  END

>  <Chemical Name>
2-Dipropylamino-indan-5-ol

>  <PubChem CID>
12728243

>  <Formula>
C15H23NO

>  <Molecular Weight>
233.355000

>  <IUPAC Name>
2-(dipropylamino)-2,3-dihydro-1H-inden-5-ol

>  <XlogP>
3.8

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
CCCN(CCC)C1CC2=C(C1)C=C(C=C2)O

>  <Isomeric SMILES>
CCCN(CCC)C1CC2=C(C1)C=C(C=C2)O

>  <InChI Std. ID>
InChI=1S/C15H23NO/c1-3-7-16(8-4-2)14-9-12-5-6-15(17)11-13(12)10-14/h5-6,11,14,17H,3-4,7-10H2,1-2H3

>  <InChI Key>
CGVTXQCPDIZHAI-UHFFFAOYSA-N

