(S)-6-Oxo-2-piperidinecarboxylic acid

C₆H₉NO₃CAS 34622-39-4143.14 g/mol

Open in Covalent MOL file

Amide Carboxylic acid Lactam

Properties

Molecular formula: C₆H₉NO₃
Molar mass: 143.14 g/mol
Exact mass: 143.0582 Da
logP: -0.26Crippen estimate
Polar surface area: 66.4 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

34622-39-4

SMILES

C1C[C@H](NC(=O)C1)C(=O)O

InChIKey

FZXCPFJMYOQZCA-BYPYZUCNSA-N

InChI

InChI=1S/C6H9NO3/c8-5-3-1-2-4(7-5)6(9)10/h4H,1-3H2,(H,7,8)(H,9,10)/t4-/m0/s1

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

Names and synonyms

1 names

(S)-2-Piperidinone-6-carboxylic acid

Work with (S)-6-Oxo-2-piperidinecarboxylic acid

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.

6-Oxo-2-piperidinecarboxylic acid3770-22-7Stereo not defined

Similar compounds

Glycyl-dl-norleucine1504-41-257 % similar Sodium N-lauroylglutamate29923-31-752 % similar Sodium stearoyl glutamate38517-23-652 % similar N-Myristoyl-L-glutamic acid sodium salt38517-37-252 % similar Pal-glu(OSu)-OH294855-91-752 % similar Proline147-85-352 % similar D-Proline344-25-252 % similar DL-Proline609-36-952 % similar

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

Same formula

2-Methoxyethyl cyanoacetate10258-54-5 Trimethadione127-48-0 N-[2-Hydroxyethyl]succinimide18190-44-8 N-Methacryloylglycine23578-45-2 Valine N-carboxyanhydride24601-74-9 5-Oxo-pyrrolidine-3-carboxylic acid methyl ester35309-35-4 Methyl 2-acetamidoacrylate35356-70-8

Elsewhere

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