Ethyl 1-piperazinecarboxylate

C₇H₁₄N₂O₂CAS 120-43-4158.20 g/mol

Open in Covalent MOL file

Carbamate Secondary amine

Properties

Molecular formula: C₇H₁₄N₂O₂
Molar mass: 158.20 g/mol
Exact mass: 158.1055 Da
Melting point: 163–164 °C
Boiling point: 237 °C
logP: 0.05Crippen estimate
Polar surface area: 41.6 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Identifiers

CAS number

120-43-4

SMILES

CCOC(=O)N1CCNCC1

InChIKey

LNOQURRKNJKKBU-UHFFFAOYSA-N

InChI

InChI=1S/C7H14N2O2/c1-2-11-7(10)9-5-3-8-4-6-9/h8H,2-6H2,1H3

Weigh it out

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

Names and synonyms

15 names · show all

1-Piperazinecarboxylic acid, ethyl ester
N-(Ethoxycarbonyl)piperazine
1-Carbethoxypiperazine
1-(Ethoxycarbonyl)piperazine
N-Carbethoxypiperazine
Ethyl N-piperazinecarboxylate
1-Carboethoxypiperazine
N-Carboethoxypiperazine
4-Carbethoxypiperazine
NSC 21060
NSC 22134
NSC 280827
N-Ethoxylcarbonylpiperazine
N-Ethoxycarbonylpiperazine
Ethoxycarbonylpiperazine

Work with Ethyl 1-piperazinecarboxylate

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ethyl 4-(methylamino)-1-piperidinecarboxylate73733-69-462 % similar 1-(Ethoxycarbonyl)-4-piperidone29976-53-261 % similar Ethyl 4-amino-1-piperidinecarboxylate58859-46-456 % similar Ethyl 4-hydroxy-1-piperidinecarboxylate65214-82-656 % similar N-Boc-piperazine57260-71-655 % similar 1-(Ethoxycarbonylmethyl)piperazine40004-08-853 % similar 1-(Ethoxycarbonyl)-4-piperidinecarboxylic acid118133-15-651 % similar tert-Butyl 1,4-diazepane-1-carboxylate112275-50-049 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook