Ethyl 4-amino-1-piperidinecarboxylate

C8H16N2O2CAS 58859-46-4172.23 g/mol

Open in Covalent MOL file
OONNH2
CarbamatePrimary amine

Properties

Molecular formula
C8H16N2O2
Molar mass
172.23 g/mol
Exact mass
172.1212 Da
logP
0.57Crippen estimate
Polar surface area
55.6 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number
58859-46-4
SMILES
CCOC(=O)N1CCC(N)CC1
InChIKey
GQQQULCEHJQUJT-UHFFFAOYSA-N
InChI
InChI=1S/C8H16N2O2/c1-2-12-8(11)10-5-3-7(9)4-6-10/h7H,2-6,9H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • 1-Piperidinecarboxylic acid, 4-amino-, ethyl ester
  • 4-Amino-1-(ethoxycarbonyl)piperidine
  • 1-Carbethoxy-4-aminopiperidine
  • 1-(Ethoxycarbonyl)-4-aminopiperidine
  • [1-(Ethoxycarbonyl)piperidin-4-yl]amine
  • 4-Aminopiperidine-1-carboxylic acid ethyl ester

Work with Ethyl 4-amino-1-piperidinecarboxylate

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 4-hydroxypiperidine-1-carboxylate65214-82-665 % similar Ethyl 4-(methylamino)-1-piperidinecarboxylate73733-69-461 % similar 1-(Ethoxycarbonyl)-4-piperidinecarboxylic acid118133-15-659 % similar tert-Butyl 4-aminopiperidine-1-carboxylate87120-72-758 % similar Ethyl 1-piperazinecarboxylate120-43-456 % similar 1-(Ethoxycarbonyl)-4-piperidone29976-53-256 % similar 4-Amino-piperidine-1-carboxylic acid benzyl ester120278-07-155 % similar 1-Boc-hexahydro-1H-azepin-4-amine196613-57-753 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Boc-3-(amino)azetidine193269-78-2 Ethyl piperazine-1-acetate40004-08-8 3-N-Boc-amino-azetidine91188-13-5

Elsewhere

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