904814-66-0 Purity
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Specification
The molecular formula of the compound is C14H17N3O2.
The molecular weight of the compound is 259.30 g/mol.
The compound was created on October 2, 2007, and last modified on December 30, 2023.
The IUPAC name of the compound is 1-(imidazo[1,2-a]pyridin-3-ylmethyl)piperidine-3-carboxylic acid.
The InChI of the compound is InChI=1S/C14H17N3O2/c18-14(19)11-4-3-6-16(9-11)10-12-8-15-13-5-1-2-7-17(12)13/h1-2,5,7-8,11H,3-4,6,9-10H2,(H,18,19).
The InChIKey of the compound is BBFZPLAHHCALCA-UHFFFAOYSA-N.
The canonical SMILES of the compound is C1CC(CN(C1)CC2=CN=C3N2C=CC=C3)C(=O)O.
The compound has 1 hydrogen bond donor count.
The topological polar surface area of the compound is 57.8 Å2.
Yes, the compound is canonicalized.