Ethyl 1-methylpiperidine-4-carboxylate

C₉H₁₇NO₂CAS 24252-37-7171.24 g/mol

Open in Covalent MOL file

Ester Tertiary amine

Properties

Molecular formula: C₉H₁₇NO₂
Molar mass: 171.24 g/mol
Exact mass: 171.1259 Da
logP: 0.89Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

24252-37-7

SMILES

CCOC(=O)C1CCN(CC1)C

InChIKey

JWXOOQCMGJBSML-UHFFFAOYSA-N

InChI

InChI=1S/C9H17NO2/c1-3-12-9(11)8-4-6-10(2)7-5-8/h8H,3-7H2,1-2H3

Weigh it out

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

Names and synonyms

1 names

Ethyl 1-methyl-4-piperidinecarboxylate

Work with Ethyl 1-methylpiperidine-4-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

Ethyl cyclopropanecarboxylate4606-07-968 % similar Ethyl 1-methyl-3-piperidinecarboxylate5166-67-666 % similar Ethyl cyclobutanecarboxylate14924-53-963 % similar Methyl N-methylisonipecotinate1690-75-163 % similar Ethyl cyclohexanecarboxylate3289-28-961 % similar Ethyl isonipecotate1126-09-658 % similar Ethyl 4-oxocyclohexanecarboxylate17159-79-458 % similar Ethyl 4-hydroxycyclohexanecarboxylate17159-80-756 % similar

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

Same formula

trans-4-Aminocyclohexane carboxylic acid ethyl ester1678-68-8 Ethyl N-piperidinylacetate23853-10-3 (Diethylamino)ethyl acrylate2426-54-2 (3R,4R)-4-Isobutylpyrrolidine-3-carboxylic acid261896-39-3 (3S,4S)-4-(2-Methylpropyl)-3-pyrrolidinecarboxylic acid261896-40-6 L-Cyclohexylalanine27527-05-5 L-Proline 1,1-dimethylethyl ester2812-46-6 Ethyl 1-methyl-2-piperidinecarboxylate30727-18-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook