1-pyrazin-2-yl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-pyrazin-2-yl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]piperidine-3-carboxamide Openeye Name: 1-pyrazin-2-yl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]piperidine-3-carboxamide CAS Name: 1-(2-pyrazinyl)-N-[3-(1-pyrrolidinylmethyl)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-pyrazin-2-yl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]piperidine-3-carboxamide Traditional Name: 1-pyrazin-2-yl-N-[3-(pyrrolidinomethyl)phenyl]nipecotamide Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=CC=C2)NC(=O)C3CCCN(C3)C4=NC=CN=C4

Isomeric SMILES

C1CCN(C1)CC2=CC(=CC=C2)NC(=O)C3CCCN(C3)C4=NC=CN=C4

InChI

InChI=1S/C21H27N5O/c27-21(18-6-4-12-26(16-18)20-14-22-8-9-23-20)24-19-7-3-5-17(13-19)15-25-10-1-2-11-25/h3,5,7-9,13-14,18H,1-2,4,6,10-12,15-16H2,(H,24,27)