(S)-3-Amino-piperidine-2,6-dione hydrochloride

C₅H₉ClN₂O₂CAS 25181-50-4164.59 g/mol

Open in Covalent MOL file

Amide Lactam Primary amine

Properties

Molecular formula: C₅H₉ClN₂O₂
Molar mass: 164.59 g/mol
Exact mass: 164.0353 Da
logP: -0.83Crippen estimate
Polar surface area: 72.2 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 0
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

25181-50-4

SMILES

C1CC(=O)NC(=O)[C@H]1N.Cl

InChIKey

YCPULGHBTPQLRH-DFWYDOINSA-N

InChI

InChI=1S/C5H8N2O2.ClH/c6-3-1-2-4(8)7-5(3)9;/h3H,1-2,6H2,(H,7,8,9);1H/t3-;/m0./s1

Weigh it out

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

Names and synonyms

1 names

(3S)-3-Aminopiperidine-2,6-dione hydrochloride

Work with (S)-3-Amino-piperidine-2,6-dione 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.

3-Amino-2,6-piperidinedione2353-44-8Free base, stereo not defined 3-Aminopiperidine-2,6-dione hydrochloride24666-56-6Stereo not defined 3-Aminopiperidine-2,6-dione hydrochloride2686-86-4Stereo not defined

Similar compounds

(3S)-3-Aminopiperidin-2-one34294-79-641 % similar L-2-Aminohexano-6-lactam21568-87-640 % similar D-Alpha-amino-epsilon-caprolactam28957-33-740 % similar Glutamic acid hydrochloride138-15-839 % similar L-Glutamine methyl ester hydrochloride32668-14-738 % similar 1,5-Dimethyl 2-aminopentanedioate hydrochloride13515-99-637 % similar Dimethyl L-glutamate hydrochloride23150-65-437 % similar Dimethyl D-glutamate hydrochloride27025-25-837 % similar

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

Elsewhere

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