N-[1-(methoxymethyl)pyrazolo[3,4-b]pyridin-4-yl]piperidine-4-carboxamide hydrate

Systemtic Name: N-[1-(methoxymethyl)pyrazolo[3,4-b]pyridin-4-yl]piperidine-4-carboxamide hydrate Openeye Name: N-[1-(methoxymethyl)pyrazolo[3,4-b]pyridin-4-yl]piperidine-4-carboxamide hydrate CAS Name: N-[1-(methoxymethyl)-4-pyrazolo[3,4-b]pyridinyl]-4-piperidinecarboxamide hydrate IUPAC Name: N-[1-(methoxymethyl)pyrazolo[3,4-b]pyridin-4-yl]piperidine-4-carboxamide hydrate Traditional Name: N-[1-(methoxymethyl)pyrazolo[3,4-b]pyridin-4-yl]isonipecotamide hydrate Formula: C14H21N5O3 MolecularWeight: 307.34824

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Descriptors Computed from Structure

Canonical SMILES:

COCN1C2=NC=CC(=C2C=N1)NC(=O)C3CCNCC3.O

Isomeric SMILES

COCN1C2=NC=CC(=C2C=N1)NC(=O)C3CCNCC3.O

InChI

InChI=1S/C14H19N5O2.H2O/c1-21-9-19-13-11(8-17-19)12(4-7-16-13)18-14(20)10-2-5-15-6-3-10;/h4,7-8,10,15H,2-3,5-6,9H2,1H3,(H,16,18,20);1H2