chempirical

N-[(1,1-Dimethylethoxy)carbonyl]-N-methylglycine [2-(methylamino)-3-pyridinyl]methyl ester

C15H23N3O4CAS 1180002-01-0309.37 g/mol

Open in Covalent MOL file
HNNOONOO
CarbamateEsterSecondary amine

Properties

Molecular formula
C15H23N3O4
Molar mass
309.37 g/mol
Exact mass
309.1689 Da
logP
2.03Crippen estimate
Polar surface area
80.8 Ų
H-bond donors / acceptors
1 / 6
Rotatable bonds
5

Identifiers

CAS number
1180002-01-0
SMILES
CNc1ncccc1COC(=O)CN(C)C(=O)OC(C)(C)C
InChIKey
SREJHHORJXVQGX-UHFFFAOYSA-N
InChI
InChI=1S/C15H23N3O4/c1-15(2,3)22-14(20)18(5)9-12(19)21-10-11-7-6-8-17-13(11)16-4/h6-8H,9-10H2,1-5H3,(H,16,17)

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Names and synonyms

4 names
  • [2-(Methylamino)pyridin-3-yl]methyl 2-[(tert-butoxycarbonyl)(methyl)amino]acetate
  • Glycine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-, [2-(methylamino)-3-pyridinyl]methyl ester
  • [2-(Methylamino)pyridin-3-yl]methyl 2-[[(tert-butoxy)carbonyl](methyl)amino]acetate
  • (2-(Methylamino)pyridin-3-yl)methyl 2-((tert-butoxycarbonyl)(methyl)amino)acetate

Work with N-[(1,1-Dimethylethoxy)carbonyl]-N-methylglycine [2-(methylamino)-3-pyridinyl]methyl ester

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Similar compounds

[(tert-Butoxycarbonyl)(methyl)amino]acetic acid13734-36-639 % similar 2-(Methylamino)-3-pyridinemethanol32399-12-538 % similar N-Boc-(methylamino)acetaldehyde123387-72-435 % similar 3-(N-Boc-methylaminomethyl)azetidine1053655-53-035 % similar N-Boc-N-methylethylenediamine121492-06-634 % similar tert-Butyl (2R,3S)-6-oxo-2,3-diphenylmorpholine-4-carboxylate112741-49-834 % similar 1,1-Dimethylethyl (2S,3R)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate112741-50-134 % similar 1-N-Boc-4-(phenylamino)piperidine125541-22-233 % similar

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

Elsewhere

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