Vitas-M small molecule compound

(1Z)-1-amino-4,4-dimethyl-1-(pyridin-4-yl)pent-1-en-3-one

Catalog ID
STK701028
SMILES N/C(=C\C(=O)C(C)(C)C)/c1ccncc1

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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 C12H16N2O MW 204.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N2O/c1-12(2,3)11(15)8-10(13)9-4-6-14-7-5-9/h4-8H,13H2,1-3H3/b10-8-
InChIKey
KBQGQZIKQNKQRB-NTMALXAHSA-N
Synonyms

(1Z)1amino44dimethyl1(pyridin4yl)pent1en3one
(E)1amino44dimethyl1(pyridin4yl)pent1en3one
(Z)1AMINO44DIMETHYL1PYRIDIN4YLPENT1EN3ONE
CC(C)(C)C(=O)C=C(C1=CC=NC=C1)N
InChI=1SC12H16N2Oc112(23)11(15)810(13)94614759h48H13H213H3b108
MFCD01460092
NC(=CC(=O)C(C)(C)C)c1ccncc1
ZINC000002287610
ZINC2287610

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Available files

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