
 CHEMBL373535

 37 39  0  0  0  0  0  0  0  0999 V2000
    1.6007   -0.3707   -0.7542 C   0  0  0  0  0
    2.5730    0.6786   -0.2263 C   0  0  0  0  0
    2.0774    1.1999    1.1157 C   0  0  0  0  0
    1.7663    2.4586    1.2951 N   0  0  0  0  0
    1.3856    2.5316    2.7373 C   0  0  0  0  0
    1.8249    1.2095    3.3761 C   0  0  0  0  0
    1.9747    0.3725    2.2120 N   0  0  0  0  0
    3.8329    0.0393   -0.0114 O   0  0  0  0  0
    4.9955    0.7488   -0.1864 C   0  0  0  0  0
    5.0326    2.1369   -0.3939 C   0  0  0  0  0
    6.2434    2.8014   -0.5923 C   0  0  0  0  0
    7.4335    2.0906   -0.5789 C   0  0  0  0  0
    7.4133    0.7157   -0.3438 C   0  0  0  0  0
    6.2070    0.0130   -0.1219 C   0  0  0  0  0
    6.2713   -1.4359    0.1975 C   0  0  0  0  0
    7.2307   -1.9452    1.0809 C   0  0  0  0  0
    7.3738   -3.2506    1.4258 N   0  0  0  0  0
    6.5028   -4.1154    0.8717 C   0  0  0  0  0
    5.5067   -3.7352   -0.0088 C   0  0  0  0  0
    5.4006   -2.3859   -0.3520 C   0  0  0  0  0
    1.8871   -0.6731   -1.7676 H   0  0  0  0  0
    0.5750    0.0125   -0.7818 H   0  0  0  0  0
    1.6160   -1.2785   -0.1402 H   0  0  0  0  0
    2.6122    1.4831   -0.9673 H   0  0  0  0  0
    1.8753    3.3837    3.2191 H   0  0  0  0  0
    0.3008    2.6652    2.8101 H   0  0  0  0  0
    1.0809    0.8178    4.0747 H   0  0  0  0  0
    2.7850    1.3209    3.8900 H   0  0  0  0  0
    2.6597   -0.3763    2.2550 H   0  0  0  0  0
    4.1341    2.7466   -0.3910 H   0  0  0  0  0
    6.2505    3.8762   -0.7565 H   0  0  0  0  0
    8.3784    2.6027   -0.7396 H   0  0  0  0  0
    8.3658    0.1877   -0.3393 H   0  0  0  0  0
    7.9474   -1.2883    1.5693 H   0  0  0  0  0
    6.6305   -5.1542    1.1623 H   0  0  0  0  0
    4.8251   -4.4695   -0.4220 H   0  0  0  0  0
    4.6286   -2.0856   -1.0563 H   0  0  0  0  0
  1  2  1  0  0  0
  1 21  1  0  0  0
  1 22  1  0  0  0
  1 23  1  0  0  0
  2  8  1  0  0  0
  2  3  1  0  0  0
  2 24  1  0  0  0
  3  4  2  0  0  0
  3  7  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
  8  9  1  0  0  0
  9 10  2  0  0  0
  9 14  1  0  0  0
 10 11  1  0  0  0
 10 30  1  0  0  0
 11 12  2  0  0  0
 11 31  1  0  0  0
 12 13  1  0  0  0
 12 32  1  0  0  0
 13 14  2  0  0  0
 13 33  1  0  0  0
 14 15  1  0  0  0
 15 16  2  0  0  0
 15 20  1  0  0  0
 16 17  1  0  0  0
 16 34  1  0  0  0
 17 18  2  0  0  0
 18 19  1  0  0  0
 18 35  1  0  0  0
 19 20  2  0  0  0
 19 36  1  0  0  0
 20 37  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL373535

>  <PubChem CID>
11265631

>  <Formula>
C16H17N3O

>  <Molecular Weight>
267.332000

>  <IUPAC Name>
3-[2-[1-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]phenyl]pyridine

>  <XlogP>
1.9

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CC(C1=NCCN1)OC2=CC=CC=C2C3=CN=CC=C3

>  <Isomeric SMILES>
CC(C1=NCCN1)OC2=CC=CC=C2C3=CN=CC=C3

>  <InChI Std. ID>
InChI=1S/C16H17N3O/c1-12(16-18-9-10-19-16)20-15-7-3-2-6-14(15)13-5-4-8-17-11-13/h2-8,11-12H,9-10H2,1H3,(H,18,19)

>  <InChI Key>
AFWQDDUMQAQVSC-UHFFFAOYSA-N

