Ethyl 2-piperidinecarboxylate

C8H15NO2CAS 15862-72-3157.21 g/mol

Open in Covalent MOL file
OOHN
EsterSecondary amine

Properties

Molecular formula
C8H15NO2
Molar mass
157.21 g/mol
Exact mass
157.1103 Da
Density
1.0065 g/mL (at 25 °C)
Boiling point
93–94 °C (at 11 Torr)
logP
0.69Crippen estimate
Polar surface area
38.3 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
2

Hazards

Warning
Flammable (GHS02)Irritant (GHS07)

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number
15862-72-3
SMILES
CCOC(=O)C1CCCCN1
InChIKey
SZIKRGHFZTYTIT-UHFFFAOYSA-N
InChI
InChI=1S/C8H15NO2/c1-2-11-8(10)7-5-3-4-6-9-7/h7,9H,2-6H2,1H3

Weigh it out

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

Names and synonyms

13 names · show all
  • 2-Piperidinecarboxylic acid, ethyl ester
  • Pipecolic acid, ethyl ester
  • Ethyl 2-pipecolate
  • Ethyl pipecolate
  • Ethyl pipecolinate
  • 2-(Ethoxycarbonyl)piperidine
  • (±)-2-Piperidinecarboxylic acid ethyl ester
  • DL-Pipecolic acid ethyl ester
  • (±)-Ethyl pipecolinate
  • NSC 49360
  • DL-Ethyl pipecolinate
  • Ethyl piperolinate
  • Ethyl piperidine-2-carboxylate

Work with Ethyl 2-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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Ethyl 2-piperidinecarboxylate35677-84-0

Similar compounds

H-D-Pro-oet hcl131477-20-881 % similar Methyl pipecolinate41994-45-064 % similar Ethyl (2R,4R)-4-methyl-2-piperidinecarboxylate74892-82-361 % similar Ethyl thiomorpholine-3-carboxylate58729-31-057 % similar 1,2-Diethyl 1,2-cyclohexanedicarboxylate10138-59-756 % similar D-Proline methyl ester43041-12-956 % similar Ethyl cyclohexanecarboxylate3289-28-955 % similar Ethyl cyclobutanecarboxylate14924-53-952 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Ethyl isonipecotate1126-09-6 Tranexamic acid1197-18-8 (αS)-α-Aminocyclohexaneacetic acid14328-51-9 D-Alpha-cyclohexylglycine14328-52-0 Methyl 4-piperidineacetate168986-49-0 1-Methylnipecotinic acid methyl ester1690-72-8 Methyl N-methylisonipecotinate1690-75-1 N-(Butoxymethyl)acrylamide1852-16-0

Elsewhere

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