1-[(2-fluorophenyl)methyl]-N-[[4-(2-pyrimidin-5-ylethynyl)phenyl]methyl]piperidin-3-amine

Systemtic Name: 1-[(2-fluorophenyl)methyl]-N-[[4-(2-pyrimidin-5-ylethynyl)phenyl]methyl]piperidin-3-amine Openeye Name: 1-[(2-fluorophenyl)methyl]-N-[[4-(2-pyrimidin-5-ylethynyl)phenyl]methyl]piperidin-3-amine CAS Name: 1-[(2-fluorophenyl)methyl]-N-[[4-[2-(5-pyrimidinyl)ethynyl]phenyl]methyl]-3-piperidinamine IUPAC Name: 1-[(2-fluorophenyl)methyl]-N-[[4-(2-pyrimidin-5-ylethynyl)phenyl]methyl]piperidin-3-amine Traditional Name: [1-(2-fluorobenzyl)-3-piperidyl]-[4-[2-(5-pyrimidyl)ethynyl]benzyl]amine Formula: C25H25FN4 MolecularWeight: 400.491203

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=CC=C2F)NCC3=CC=C(C=C3)C#CC4=CN=CN=C4

Isomeric SMILES

C1CC(CN(C1)CC2=CC=CC=C2F)NCC3=CC=C(C=C3)C#CC4=CN=CN=C4

InChI

InChI=1S/C25H25FN4/c26-25-6-2-1-4-23(25)17-30-13-3-5-24(18-30)29-16-21-10-7-20(8-11-21)9-12-22-14-27-19-28-15-22/h1-2,4,6-8,10-11,14-15,19,24,29H,3,5,13,16-18H2