
 SCHEMBL2299672

 37 39  0  0  0  0  0  0  0  0999 V2000
    1.1644   -0.2830    0.4990 C   0  0  0  0  0
    2.5891   -0.5642    0.7631 C   0  0  0  0  0
    3.1429   -1.6814    1.1998 N   0  0  0  0  0
    4.4784   -1.3734    1.2697 C   0  0  0  0  0
    4.6694   -0.0633    0.8587 C   0  0  0  0  0
    3.4632    0.4676    0.5275 O   0  0  0  0  0
    5.8962    0.5173    0.8155 C   0  0  0  0  0
    7.0032   -0.2538    1.2214 C   0  0  0  0  0
    8.2680    0.5274    1.1233 C   0  0  0  0  0
    7.7541    1.9763    0.8673 C   0  0  0  0  0
    6.2629    1.8951    0.3937 C   0  0  0  0  0
    6.0776    2.1452   -1.1085 C   0  0  0  0  0
    6.8238    1.1754   -2.0278 C   0  0  0  0  0
    6.6071    1.4956   -3.4246 N   0  0  0  0  0
    7.3722    2.4319   -4.0828 C   0  0  0  0  0
    8.2888    3.0569   -3.5622 O   0  0  0  0  0
    6.9620    2.6349   -5.5160 C   0  0  0  0  0
    6.8980   -1.5769    1.6469 C   0  0  0  0  0
    5.6000   -2.1360    1.6643 C   0  0  0  0  0
    0.5629   -1.1886    0.6217 H   0  0  0  0  0
    1.0276    0.0828   -0.5230 H   0  0  0  0  0
    0.7901    0.4747    1.1937 H   0  0  0  0  0
    8.8570    0.4665    2.0426 H   0  0  0  0  0
    8.8578    0.1656    0.2753 H   0  0  0  0  0
    8.4011    2.5272    0.1767 H   0  0  0  0  0
    7.7824    2.5207    1.8215 H   0  0  0  0  0
    5.6661    2.6233    0.9563 H   0  0  0  0  0
    6.3958    3.1722   -1.3309 H   0  0  0  0  0
    5.0074    2.1050   -1.3521 H   0  0  0  0  0
    6.4711    0.1488   -1.8884 H   0  0  0  0  0
    7.9001    1.1989   -1.8317 H   0  0  0  0  0
    5.8068    1.0910   -3.8930 H   0  0  0  0  0
    6.0213    3.1900   -5.5521 H   0  0  0  0  0
    6.8419    1.6694   -6.0159 H   0  0  0  0  0
    7.7359    3.2018   -6.0410 H   0  0  0  0  0
    7.7684   -2.1489    1.9492 H   0  0  0  0  0
    5.4538   -3.1628    1.9854 H   0  0  0  0  0
  1  2  1  0  0  0
  1 20  1  0  0  0
  1 21  1  0  0  0
  1 22  1  0  0  0
  2  3  2  0  0  0
  2  6  1  0  0  0
  3  4  1  0  0  0
  4 19  1  0  0  0
  4  5  2  0  0  0
  5  6  1  0  0  0
  5  7  1  0  0  0
  7  8  2  0  0  0
  7 11  1  0  0  0
  8  9  1  0  0  0
  8 18  1  0  0  0
  9 10  1  0  0  0
  9 23  1  0  0  0
  9 24  1  0  0  0
 10 11  1  0  0  0
 10 25  1  0  0  0
 10 26  1  0  0  0
 11 12  1  0  0  0
 11 27  1  0  0  0
 12 13  1  0  0  0
 12 28  1  0  0  0
 12 29  1  0  0  0
 13 14  1  0  0  0
 13 30  1  0  0  0
 13 31  1  0  0  0
 14 15  1  0  0  0
 14 32  1  0  0  0
 15 17  1  0  0  0
 15 16  2  0  0  0
 17 33  1  0  0  0
 17 34  1  0  0  0
 17 35  1  0  0  0
 18 19  2  0  0  0
 18 36  1  0  0  0
 19 37  1  0  0  0
M  END

>  <Chemical Name>
SCHEMBL2299672

>  <PubChem CID>
23725513

>  <Formula>
C15H18N2O2

>  <Molecular Weight>
258.321000

>  <IUPAC Name>
N-[2-[(8R)-2-methyl-7,8-dihydro-6H-cyclopenta[g][1,3]benzoxazol-8-yl]ethyl]acetamide

>  <XlogP>
2.5

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CC1=NC2=C(O1)C3=C(CCC3CCNC(=O)C)C=C2

>  <Isomeric SMILES>
CC1=NC2=C(O1)C3=C(CC[C@@H]3CCNC(=O)C)C=C2

>  <InChI Std. ID>
InChI=1S/C15H18N2O2/c1-9(18)16-8-7-12-4-3-11-5-6-13-15(14(11)12)19-10(2)17-13/h5-6,12H,3-4,7-8H2,1-2H3,(H,16,18)/t12-/m1/s1

>  <InChI Key>
CCRUCMHMQXUZAT-GFCCVEGCSA-N

