3-[1-[(2-azanylpyrimidin-5-yl)methyl]piperidin-1-ium-4-yl]-N-cyclopropyl-propanamide

Systemtic Name: 3-[1-[(2-azanylpyrimidin-5-yl)methyl]piperidin-1-ium-4-yl]-N-cyclopropyl-propanamide Openeye Name: 3-[1-[(2-aminopyrimidin-5-yl)methyl]piperidin-1-ium-4-yl]-N-cyclopropyl-propanamide CAS Name: 3-[1-[(2-amino-5-pyrimidinyl)methyl]-4-piperidin-1-iumyl]-N-cyclopropylpropanamide IUPAC Name: 3-[1-[(2-aminopyrimidin-5-yl)methyl]piperidin-1-ium-4-yl]-N-cyclopropylpropanamide Traditional Name: 3-[1-[(2-aminopyrimidin-5-yl)methyl]piperidin-1-ium-4-yl]-N-cyclopropyl-propionamide Formula: C16H26N5O+ MolecularWeight: 304.41054

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CCC2CC[NH+](CC2)CC3=CN=C(N=C3)N

Isomeric SMILES

C1CC1NC(=O)CCC2CC[NH+](CC2)CC3=CN=C(N=C3)N

InChI

InChI=1S/C16H25N5O/c17-16-18-9-13(10-19-16)11-21-7-5-12(6-8-21)1-4-15(22)20-14-2-3-14/h9-10,12,14H,1-8,11H2,(H,20,22)(H2,17,18,19)/p+1