Vitas-M small molecule compound

(2E)-3-(4-methylphenyl)-1-(2-methylpiperidin-1-yl)prop-2-en-1-one

Catalog ID
STK439402
SMILES Cc1ccc(cc1)/C=C/C(=O)N1CCCCC1C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C16H21NO MW 243.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21NO/c1-13-6-8-15(9-7-13)10-11-16(18)17-12-4-3-5-14(17)2/h6-11,14H,3-5,12H2,1-2H3/b11-10+
InChIKey
KJYMTUIMFCTMFX-ZHACJKMWSA-N
Synonyms

(2E)3(4methylphenyl)1(2methylpiperidin1yl)prop2en1one
(2E)3(4METHYLPHENYL)1(2METHYLPIPERIDYL)PROP2EN1ONE
(E)3(4METHYLPHENYL)1(2METHYLPIPERIDIN1YL)PROP2EN1ONE
Cc1ccc(cc1)C=CC(=O)N1CCCCC1C
CC1CCCCN1C(=O)C=CC2=CC=C(C=C2)C
InChI=1SC16H21NOc1136815(9713)101116(18)171243514(17)2h61114H3512H212H3b1110+
MFCD03366254
ZINC000000475833
ZINC000000475835

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.