2-(2-Oxopyrrolidin-1-yl)acetic acid

C₆H₉NO₃CAS 53934-76-2143.14 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
Melting point: 143 °C
logP: -0.31Crippen estimate
Polar surface area: 57.6 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Hazards

Warning

H319 Causes serious eye irritation97.7% of notifiers

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264+P265, P280, P305+P351+P338, P337+P317

Identifiers

CAS number

53934-76-2

SMILES

O=C(O)CN1CCCC1=O

InChIKey

JGPIWNNFLKDTSR-UHFFFAOYSA-N

InChI

InChI=1S/C6H9NO3/c8-5-2-1-3-7(5)4-6(9)10/h1-4H2,(H,9,10)

Weigh it out

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

Names and synonyms

5 names

2-Oxo-1-pyrrolidineacetic acid
1-Pyrrolidineacetic acid, 2-oxo-
2-Pyrrolidinoneacetic acid
(2-Oxopyrrolidin-1-yl)acetic acid
2-Pyrrolidinon-1-ylacetic acid

Work with 2-(2-Oxopyrrolidin-1-yl)acetic 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

Similar compounds

Piracetam7491-74-961 % similar N-(Hydroxymethyl)-2-pyrrolidone15438-71-855 % similar 1-(2-Hydroxyethyl)-2-pyrrolidinone3445-11-253 % similar 1-(3-Hydroxypropyl)pyrrolidin-2-one62012-15-153 % similar N-Ethyl-2-pyrrolidone2687-91-450 % similar Methyl 2-oxo-1-pyrrolidineacetate59776-88-450 % similar N-Butyl-2-pyrrolidone3470-98-248 % similar 1-(3-Aminopropyl)-2-pyrrolidinone7663-77-648 % 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 (S)-6-Oxo-2-piperidinecarboxylic acid34622-39-4 5-Oxo-pyrrolidine-3-carboxylic acid methyl ester35309-35-4 Methyl 2-acetamidoacrylate35356-70-8

Elsewhere

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