Methyl N-Cbz-piperidine-3-carboxylate

C₁₅H₁₉NO₄CAS 174543-74-9277.32 g/mol

Open in Covalent MOL file

Carbamate Ester

Properties

Molecular formula: C₁₅H₁₉NO₄
Molar mass: 277.32 g/mol
Exact mass: 277.1314 Da
logP: 2.21Crippen estimate
Polar surface area: 55.8 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 3

Identifiers

CAS number

174543-74-9

SMILES

COC(=O)C1CCCN(C1)C(=O)OCC2=CC=CC=C2

InChIKey

BMBZPWAQRLLZBC-UHFFFAOYSA-N

InChI

InChI=1S/C15H19NO4/c1-19-14(17)13-8-5-9-16(10-13)15(18)20-11-12-6-3-2-4-7-12/h2-4,6-7,13H,5,8-11H2,1H3

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Names and synonyms

1 names

Piperidine-1,3-dicarboxylic acid 1-benzyl ester 3-methyl ester

Work with Methyl N-Cbz-piperidine-3-carboxylate

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

3-Methyl 1-(phenylmethyl) 1,3-piperazinedicarboxylate129799-11-764 % similar Phenylmethyl 3-amino-1-piperidinecarboxylate711002-74-362 % similar Phenylmethyl 3-(aminomethyl)-1-piperidinecarboxylate315717-76-160 % similar Phenylmethyl 3-(hydroxymethyl)-1-piperidinecarboxylate39945-51-260 % similar Methyl N-boc-piperidine-3-carboxylate148763-41-158 % similar 1-N-Cbz-pyrrolidine-3-carboxylic acid188527-21-158 % similar (S)-1-Cbz-3-aminopyrrolidine122536-72-555 % similar Phenylmethyl (3R)-3-amino-1-pyrrolidinecarboxylate122536-73-655 % similar

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

Same formula

Boc-D-tic-oh115962-35-1 2-(tert-Butoxycarbonyl)-1,2,3,4-tetrahydroisoquinoline-7-carboxylic acid149353-95-7 1-[(Benzyloxy)carbonyl]-4-methylpiperidine-4-carboxylic acid203522-12-7 N,N,O-Triglycidyl-P-aminophenol5026-74-4

Elsewhere

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