3-[2-[(piperidin-4-ylmethylamino)methyl]-4-pyridin-2-yl-phenoxy]propan-1-amine

Systemtic Name: 3-[2-[(piperidin-4-ylmethylamino)methyl]-4-pyridin-2-yl-phenoxy]propan-1-amine Openeye Name: 3-[2-[(4-piperidylmethylamino)methyl]-4-(2-pyridyl)phenoxy]propan-1-amine CAS Name: 3-[2-[(4-piperidinylmethylamino)methyl]-4-(2-pyridinyl)phenoxy]-1-propanamine IUPAC Name: 3-[2-[(piperidin-4-ylmethylamino)methyl]-4-pyridin-2-ylphenoxy]propan-1-amine Traditional Name: [2-(3-aminopropoxy)-5-(2-pyridyl)benzyl]-(4-piperidylmethyl)amine Formula: C21H30N4O MolecularWeight: 354.4891

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CNCC2=C(C=CC(=C2)C3=CC=CC=N3)OCCCN

Isomeric SMILES

C1CNCCC1CNCC2=C(C=CC(=C2)C3=CC=CC=N3)OCCCN

InChI

InChI=1S/C21H30N4O/c22-9-3-13-26-21-6-5-18(20-4-1-2-10-25-20)14-19(21)16-24-15-17-7-11-23-12-8-17/h1-2,4-6,10,14,17,23-24H,3,7-9,11-13,15-16,22H2