1-[2-Amino-5-methoxy-4-(phenylmethoxy)phenyl]ethanone

C₁₆H₁₇NO₃CAS 75665-73-5271.32 g/mol

Open in Covalent MOL file

Ether Ketone Primary amine

Properties

Molecular formula: C₁₆H₁₇NO₃
Molar mass: 271.32 g/mol
Exact mass: 271.1208 Da
logP: 3.06Crippen estimate
Polar surface area: 61.6 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 5

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

75665-73-5

SMILES

CC(=O)C1=CC(=C(C=C1N)OCC2=CC=CC=C2)OC

InChIKey

ODOYPGHNQKAPBX-UHFFFAOYSA-N

InChI

InChI=1S/C16H17NO3/c1-11(18)13-8-15(19-2)16(9-14(13)17)20-10-12-6-4-3-5-7-12/h3-9H,10,17H2,1-2H3

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Names and synonyms

1 names

1-(2-Amino-4-(benzyloxy)-5-methoxyphenyl)ethanone

Work with 1-[2-Amino-5-methoxy-4-(phenylmethoxy)phenyl]ethanone

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

Similar compounds

1-(4-Benzyloxy-3-methoxyphenyl)ethanone1835-11-669 % similar 2'-Amino-4',5'-dimethoxyacetophenone4101-30-867 % similar 1-[2-(Benzyloxy)phenyl]ethan-1-one31165-67-060 % similar 1-(6-Amino-1,3-benzodioxol-5-yl)ethanone28657-75-260 % similar 2′-Amino-4′,5′-methylenedioxyacetophenone hydrochloride93983-01-859 % similar 1-(2,5-Bis(benzyloxy)phenyl)ethanone21766-81-457 % similar 2-Bromo-4-methoxy-5-(phenylmethoxy)benzoic acid24958-42-756 % similar 4-(Benzyloxy)-3-methoxybenzoic acid1486-53-951 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

O-Benzyl-L-tyrosine16652-64-5 Higenamine5843-65-2

Elsewhere

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