N-(3-methylbutyl)-1-[1-(pyridin-4-ylmethyl)piperidin-4-yl]piperidine-3-carboxamide

Systemtic Name: N-(3-methylbutyl)-1-[1-(pyridin-4-ylmethyl)piperidin-4-yl]piperidine-3-carboxamide Openeye Name: N-isopentyl-1-[1-(4-pyridylmethyl)-4-piperidyl]piperidine-3-carboxamide CAS Name: N-(3-methylbutyl)-1-[1-(pyridin-4-ylmethyl)-4-piperidinyl]-3-piperidinecarboxamide IUPAC Name: N-(3-methylbutyl)-1-[1-(pyridin-4-ylmethyl)piperidin-4-yl]piperidine-3-carboxamide Traditional Name: N-isoamyl-1-[1-(4-pyridylmethyl)-4-piperidyl]nipecotamide Formula: C22H36N4O MolecularWeight: 372.54744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1CCCN(C1)C2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

CC(C)CCNC(=O)C1CCCN(C1)C2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C22H36N4O/c1-18(2)5-12-24-22(27)20-4-3-13-26(17-20)21-8-14-25(15-9-21)16-19-6-10-23-11-7-19/h6-7,10-11,18,20-21H,3-5,8-9,12-17H2,1-2H3,(H,24,27)