chempirical

(R)-Piperidine-3-carboxylic acid ethyl ester hydrochloride

C8H16ClNO2CAS 37675-19-7193.67 g/mol

Open in Covalent MOL file
OONHHCl
EsterSecondary amine

Properties

Molecular formula
C8H16ClNO2
Molar mass
193.67 g/mol
Exact mass
193.0870 Da
logP
0.97Crippen estimate
Polar surface area
38.3 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
2
Stereocentres
Rin SMILES atom order

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
37675-19-7
SMILES
CCOC(=O)[C@@H]1CCCNC1.Cl
InChIKey
ZCEGLOKZSLNARG-OGFXRTJISA-N
InChI
InChI=1S/C8H15NO2.ClH/c1-2-11-8(10)7-4-3-5-9-6-7;/h7,9H,2-6H2,1H3;1H/t7-;/m1./s1

Weigh it out

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

Work with (R)-Piperidine-3-carboxylic acid ethyl ester hydrochloride

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 nipecotate25137-01-3Free base (+)-Ethyl nipecotate37675-18-6Free base, enantiomer Ethyl nipecotate5006-62-2Free base, stereo not defined Ethyl nipecotate71962-74-8Free base, stereo not defined

Similar compounds

Ethyl pyrrolidine-3-carboxylate hydrochloride80028-44-082 % similar (S)-3-Methyl piperidine carboxylate hydrochloride164323-84-668 % similar Methyl (3R)-3-piperidinecarboxylate164323-85-759 % similar Methyl piperidine-3-carboxylate50585-89-259 % similar H-D-Pro-oet hcl131477-20-859 % similar Ethyl cyclobutanecarboxylate14924-53-959 % similar Ethyl isonipecotate1126-09-658 % similar Ethyl cyclohexanecarboxylate3289-28-957 % similar

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

Same formula

Piperidine-4-carboxylic acid ethyl ester hydrochloride147636-76-8 Acryloyloxyethyltrimethylammonium chloride44992-01-0 Methyl trans-4-aminocyclohexanecarboxylate hydrochloride61367-07-5

Elsewhere

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