4-(aminomethyl)-N-[3-(dimethylaminomethyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-(aminomethyl)-N-[3-(dimethylaminomethyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]cyclohexane-1-carboxamide Openeye Name: 4-(aminomethyl)-N-[3-(dimethylaminomethyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]cyclohexanecarboxamide CAS Name: 4-(aminomethyl)-N-[3-(dimethylaminomethyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]-1-cyclohexanecarboxamide IUPAC Name: 4-(aminomethyl)-N-[3-(dimethylaminomethyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]cyclohexane-1-carboxamide Traditional Name: 4-(aminomethyl)-N-[3-(dimethylaminomethyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]cyclohexanecarboxamide Formula: C18H27N5O MolecularWeight: 329.43988

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CNC2=NC=CC(=C12)NC(=O)C3CCC(CC3)CN

Isomeric SMILES

CN(C)CC1=CNC2=NC=CC(=C12)NC(=O)C3CCC(CC3)CN

InChI

InChI=1S/C18H27N5O/c1-23(2)11-14-10-21-17-16(14)15(7-8-20-17)22-18(24)13-5-3-12(9-19)4-6-13/h7-8,10,12-13H,3-6,9,11,19H2,1-2H3,(H2,20,21,22,24)