5-fluoranyl-2-[(3R)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]pyrimidin-4-amine

Systemtic Name: 5-fluoranyl-2-[(3R)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]pyrimidin-4-amine Openeye Name: 5-fluoro-2-[(3R)-3-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]pyrimidin-4-amine CAS Name: 5-fluoro-2-[(3R)-3-[1-(3-pyridinylmethyl)-4-piperidin-1-iumyl]-1-pyrrolidinyl]-4-pyrimidinamine IUPAC Name: 5-fluoro-2-[(3R)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]pyrimidin-4-amine Traditional Name: [5-fluoro-2-[(3R)-3-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]pyrrolidino]pyrimidin-4-yl]amine Formula: C19H26FN6+ MolecularWeight: 357.448343

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2CCN(C2)C3=NC=C(C(=N3)N)F)CC4=CN=CC=C4

Isomeric SMILES

C1CN(C[C@H]1C2CC[NH+](CC2)CC3=CN=CC=C3)C4=NC=C(C(=N4)N)F

InChI

InChI=1S/C19H25FN6/c20-17-11-23-19(24-18(17)21)26-9-5-16(13-26)15-3-7-25(8-4-15)12-14-2-1-6-22-10-14/h1-2,6,10-11,15-16H,3-5,7-9,12-13H2,(H2,21,23,24)/p+1/t16-/m0/s1