Ethyl 2-(dibenzylamino)acetate

C₁₈H₂₁NO₂CAS 77385-90-1283.37 g/mol

Open in Covalent MOL file

Ester Tertiary amine

Properties

Molecular formula: C₁₈H₂₁NO₂
Molar mass: 283.37 g/mol
Exact mass: 283.1572 Da
logP: 3.25Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 7

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

77385-90-1

SMILES

CCOC(=O)CN(CC1=CC=CC=C1)CC2=CC=CC=C2

InChIKey

AFMDCFOWHWNQBP-UHFFFAOYSA-N

InChI

InChI=1S/C18H21NO2/c1-2-21-18(20)15-19(13-16-9-5-3-6-10-16)14-17-11-7-4-8-12-17/h3-12H,2,13-15H2,1H3

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Names and synonyms

1 names

N,N-Dibenzylglycine ethyl ester

Work with Ethyl 2-(dibenzylamino)acetate

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

Ethyl phenylacetate101-97-373 % similar Ethyl 3-phenylpropanoate2021-28-561 % similar 3-Oxo-4-phenyl-butyric acid ethyl ester718-08-159 % similar Benzyl ethyl malonate42998-51-658 % similar Ethyl 1-(phenylmethyl)-4-piperidinecarboxylate24228-40-856 % similar Ethyl 1-benzyl-4-oxopyrrolidine-3-carboxylate1027-35-656 % similar Ethyl 2-[4-(dimethylamino)phenyl]acetate17078-29-455 % similar N-Benzylglycine ethyl ester6436-90-455 % similar

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

Elsewhere

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