
 CHEMBL1975200

 54 57  0  0  0  0  0  0  0  0999 V2000
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   -5.5212   -0.0626    6.1376 C   0  0  0  0  0
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   -6.9422   -0.5455    6.3476 C   0  0  0  0  0
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    0.3620   -0.0579    1.8481 H   0  0  0  0  0
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    2.2528   -5.0214    3.4402 H   0  0  0  0  0
    1.5636   -3.9303    2.2936 H   0  0  0  0  0
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  3  4  1  0  0  0
  3 29  1  0  0  0
  3 30  1  0  0  0
  4  5  1  0  0  0
  4  7  1  0  0  0
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  5  6  1  0  0  0
  5 32  1  0  0  0
  5 33  1  0  0  0
  6 34  1  0  0  0
  6 35  1  0  0  0
  7  8  1  0  0  0
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  7 37  1  0  0  0
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  8  9  1  0  0  0
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M  END

>  <Chemical Name>
CHEMBL1975200

>  <PubChem CID>
25110494

>  <Formula>
C20H30N2O2

>  <Molecular Weight>
330.472000

>  <IUPAC Name>
N-cyclohexyl-N-(cyclohexylmethyl)-5-cyclopropyl-1,2-oxazole-3-carboxamide

>  <XlogP>
4.900

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
C1CCC(CC1)CN(C2CCCCC2)C(=O)C3=NOC(=C3)C4CC4

>  <Isomeric SMILES>
C1CCC(CC1)CN(C2CCCCC2)C(=O)C3=NOC(=C3)C4CC4

>  <InChI Std. ID>
InChI=1S/C20H30N2O2/c23-20(18-13-19(24-21-18)16-11-12-16)22(17-9-5-2-6-10-17)14-15-7-3-1-4-8-15/h13,15-17H,1-12,14H2

>  <InChI Key>
BFVBQCJQPCGPDH-UHFFFAOYSA-N

