Vitas-M small molecule compound

3-[(1-benzylpiperidin-4-yl)amino]-5,5-dimethylcyclohex-2-en-1-one

Catalog ID
STL357429
SMILES O=C1C=C(NC2CCN(CC2)Cc2ccccc2)CC(C1)(C)C

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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 C20H28N2O MW 312.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N2O/c1-20(2)13-18(12-19(23)14-20)21-17-8-10-22(11-9-17)15-16-6-4-3-5-7-16/h3-7,12,17,21H,8-11,13-15H2,1-2H3
InChIKey
YCZPOAVAVBRRSK-UHFFFAOYSA-N
Synonyms
371222-69-4
3((1benzylpiperidin4yl)amino)55dimethylcyclohex2en1one
3((1benzylpiperidin4yl)amino)55dimethylcyclohex2enone
3(1BENZYLPIPERIDIN4YLAMINO)55DIMETHYLCYCLOHEX2ENONE
371222694
CC1(CC(=CC(=O)C1)NC2CCN(CC2)CC3=CC=CC=C3)C
InChI=1SC20H28N2Oc120(2)1318(1219(23)1420)211781022(11917)15166435716h37121721H8111315H212H3
MFCD00813262
ZINC000100379626
ZINC100379626

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Available files

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