4-(4-Acetyl-1-piperazinyl)-2-(methyloxy)aniline

C₁₃H₁₉N₃O₂CAS 1021426-42-5249.31 g/mol

Open in Covalent MOL file

Amide Ether Primary amine Tertiary amine

Properties

Molecular formula: C₁₃H₁₉N₃O₂
Molar mass: 249.31 g/mol
Exact mass: 249.1477 Da
logP: 0.95Crippen estimate
Polar surface area: 58.8 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 2

Identifiers

CAS number

1021426-42-5

SMILES

CC(=O)N1CCN(CC1)C2=CC(=C(C=C2)N)OC

InChIKey

OJCNMAFGNSFBOO-UHFFFAOYSA-N

InChI

InChI=1S/C13H19N3O2/c1-10(17)15-5-7-16(8-6-15)11-3-4-12(14)13(9-11)18-2/h3-4,9H,5-8,14H2,1-2H3

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Names and synonyms

1 names

1-(4-(4-Amino-3-methoxyphenyl)piperazin-1-yl)ethanone

Work with 4-(4-Acetyl-1-piperazinyl)-2-(methyloxy)aniline

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

(2S,5R)-5-[(Phenylmethoxy)amino]-2-piperidinecarboxamide1416134-49-0

Elsewhere

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