N-[3-[(2-Cyanoethyl)ethylamino]-4-methoxyphenyl]acetamide

C₁₄H₁₉N₃O₂CAS 19433-94-4261.32 g/mol

Open in Covalent MOL file

Ether Nitrile Tertiary amine

Properties

Molecular formula: C₁₄H₁₉N₃O₂
Molar mass: 261.32 g/mol
Exact mass: 261.1477 Da
logP: 3.04Crippen estimate
Polar surface area: 68.8 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 6

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H412 Harmful to aquatic life with long lasting effects100% of notifiers

Aggregated from 9 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P273, P301+P317, P330, P501

Identifiers

CAS number

19433-94-4

SMILES

CCN(CCC#N)c1cc(N=C(C)O)ccc1OC

InChIKey

GMJYHCWSTTTWRT-UHFFFAOYSA-N

InChI

InChI=1S/C14H19N3O2/c1-4-17(9-5-8-15)13-10-12(16-11(2)18)6-7-14(13)19-3/h6-7,10H,4-5,9H2,1-3H3,(H,16,18)

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Names and synonyms

2 names

Acetamide, N-[3-[(2-cyanoethyl)ethylamino]-4-methoxyphenyl]-
p-Acetanisidide, 3′-[(2-cyanoethyl)ethylamino]-

Work with N-[3-[(2-Cyanoethyl)ethylamino]-4-methoxyphenyl]acetamide

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

N-[3-(Diethylamino)-4-methoxyphenyl]acetamide19433-93-377 % similar N-[3-[Bis(2-hydroxyethyl)amino]-4-methoxyphenyl]acetamide24530-67-463 % similar N-[3-[(2-Cyanoethyl)amino]-4-methoxyphenyl]acetamide26408-28-659 % similar N-[3-(Di-2-propen-1-ylamino)-4-methoxyphenyl]acetamide51868-45-258 % similar N-[3-[Bis[2-(acetyloxy)ethyl]amino]-4-methoxyphenyl]acetamide23128-51-057 % similar N-(3-Amino-4-methoxyphenyl)acetamide6375-47-948 % similar N-[3-(Diethylamino)phenyl]acetamide6375-46-844 % similar N-1,3-Benzodioxol-5-ylacetamide13067-19-142 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Zilpaterol117827-79-9 Ethyl 5-amino-1-methyl-1H-benzimidazole-2-butanoate3543-73-5

Elsewhere

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