3-[pyridin-3-ylmethyl(pyrimidin-2-yl)amino]propylazanium

Systemtic Name: 3-[pyridin-3-ylmethyl(pyrimidin-2-yl)amino]propylazanium Openeye Name: 3-[3-pyridylmethyl(pyrimidin-2-yl)amino]propylammonium CAS Name: 3-[3-pyridinylmethyl(2-pyrimidinyl)amino]propylammonium IUPAC Name: 3-[pyridin-3-ylmethyl(pyrimidin-2-yl)amino]propylazanium Traditional Name: 3-[3-pyridylmethyl(2-pyrimidyl)amino]propylammonium Formula: C13H18N5+ MolecularWeight: 244.31552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN(CCC[NH3+])C2=NC=CC=N2

Isomeric SMILES

C1=CC(=CN=C1)CN(CCC[NH3+])C2=NC=CC=N2

InChI

InChI=1S/C13H17N5/c14-5-2-9-18(13-16-7-3-8-17-13)11-12-4-1-6-15-10-12/h1,3-4,6-8,10H,2,5,9,11,14H2/p+1