Isohexylone

Molecular structure via molpic based on CDK

Rotamer []
Conformer structure via 3Dmol.js
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Physical properties []
Molecular mass	249.30 g/mol [1]
Predicted LogP	2.7 [1]

Structural Identifiers []
Molecular formula	C14H19NO3 [1]
IUPAC name	1-(1,3-benzodioxol-5-yl)-4-methyl-2-(methylamino)pentan-1-one [1]
SMILES	CC(C)CC(C(=O)C1=CC2=C(C=C1)OCO2)NC [1]
InChI	InChI=1S/C14H19NO3/c1-9(2)6-11(15-3)14(16)10-4-5-12-13(7-10)18-8-17-12/h4-5,7,9,11,15H,6,8H2,1-3H3 [1]
InChIKey	QGIZGJMDLJAAJI-UHFFFAOYSA-N [1]

Isohexylone

Isohexylone (also known as 1-(1,3-benzodioxol-5-yl)-2-[methyl(2-methylpropyl)amino]ethanone) is a substance of the cathinone and methylenedioxyphenethylamine class.