
 CHEMBL2387282

 62 65  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL2387282

>  <PubChem CID>
25264262

>  <Formula>
C22H33N5O2

>  <Molecular Weight>
399.539000

>  <IUPAC Name>
4-acetyl-N-[4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]piperazine-1-carboxamide

>  <XlogP>
1.7

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CC1CCCN1C2CCN(C2)C3=CC=C(C=C3)NC(=O)N4CCN(CC4)C(=O)C

>  <Isomeric SMILES>
CC1CCCN1C2CCN(C2)C3=CC=C(C=C3)NC(=O)N4CCN(CC4)C(=O)C

>  <InChI Std. ID>
InChI=1S/C22H33N5O2/c1-17-4-3-10-27(17)21-9-11-26(16-21)20-7-5-19(6-8-20)23-22(29)25-14-12-24(13-15-25)18(2)28/h5-8,17,21H,3-4,9-16H2,1-2H3,(H,23,29)

>  <InChI Key>
BCCVUKGKQRRJOM-UHFFFAOYSA-N

