Succinimide

This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.

Identification

Generic Name
Succinimide
DrugBank Accession Number
DB13376
Background

Not Available

Type
Small Molecule
Groups
Experimental
Structure
Weight
Average: 99.089
Monoisotopic: 99.032028405
Chemical Formula
C4H5NO2
Synonyms
Not Available

Pharmacology

Indication

Not Available

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Contraindications & Blackbox Warnings
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Pharmacodynamics

Not Available

Mechanism of action
Not Available
Absorption

Not Available

Volume of distribution

Not Available

Protein binding

Not Available

Metabolism
Not Available
Route of elimination

Not Available

Half-life

Not Available

Clearance

Not Available

Adverse Effects
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Toxicity

Not Available

Pathways
Not Available
Pharmacogenomic Effects/ADRs
Not Available

Interactions

Drug Interactions
This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.
Not Available
Food Interactions
Not Available

Categories

ATC Codes
G04BX10 — Succinimide
Drug Categories
Chemical TaxonomyProvided by Classyfire
Description
This compound belongs to the class of organic compounds known as pyrrolidine-2-ones. These are pyrrolidines which bear a C=O group at position 2 of the pyrrolidine ring.
Kingdom
Organic compounds
Super Class
Organoheterocyclic compounds
Class
Pyrrolidines
Sub Class
Pyrrolidones
Direct Parent
Pyrrolidine-2-ones
Alternative Parents
N-unsubstituted carboxylic acid imides / Dicarboximides / Lactams / Azacyclic compounds / Organopnictogen compounds / Organonitrogen compounds / Organic oxides / Hydrocarbon derivatives / Carbonyl compounds
Substituents
2-pyrrolidone / Aliphatic heteromonocyclic compound / Azacycle / Carbonyl group / Carboxylic acid derivative / Carboxylic acid imide / Carboxylic acid imide, n-unsubstituted / Dicarboximide / Hydrocarbon derivative / Lactam
Molecular Framework
Aliphatic heteromonocyclic compounds
External Descriptors
pyrrolidinone, dicarboximide (CHEBI:9307) / a small molecule (SUCCIMIDE)
Affected organisms
Not Available

Chemical Identifiers

UNII
10X90O3503
CAS number
123-56-8
InChI Key
KZNICNPSHKQLFF-UHFFFAOYSA-N
InChI
InChI=1S/C4H5NO2/c6-3-1-2-4(7)5-3/h1-2H2,(H,5,6,7)
IUPAC Name
pyrrolidine-2,5-dione
SMILES
O=C1CCC(=O)N1

References

General References
Not Available
KEGG Compound
C07273
ChemSpider
10955
BindingDB
7814
ChEBI
9307
ChEMBL
CHEMBL275661
ZINC
ZINC000005133396
Wikipedia
Succinimide

Clinical Trials

Clinical Trials
PhaseStatusPurposeConditionsCount

Pharmacoeconomics

Manufacturers
Not Available
Packagers
Not Available
Dosage Forms
Not Available
Prices
Not Available
Patents
Not Available

Properties

State
Not Available
Experimental Properties
Not Available
Predicted Properties
PropertyValueSource
Water Solubility228.0 mg/mLALOGPS
logP-0.9ALOGPS
logP-0.99Chemaxon
logS0.36ALOGPS
pKa (Strongest Acidic)9.9Chemaxon
pKa (Strongest Basic)-7.2Chemaxon
Physiological Charge0Chemaxon
Hydrogen Acceptor Count2Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area46.17 Å2Chemaxon
Rotatable Bond Count0Chemaxon
Refractivity22.28 m3·mol-1Chemaxon
Polarizability8.82 Å3Chemaxon
Number of Rings1Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon
Predicted ADMET Features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
SpectrumSpectrum TypeSplash Key
GC-MS Spectrum - EI-BGC-MSsplash10-052b-9000000000-4ed377ae4cbafaf0ea7a
GC-MS Spectrum - EI-BGC-MSsplash10-0a4j-9000000000-f7f25638445e86e5701b
LC-MS/MS Spectrum - LC-ESI-QQ , negativeLC-MS/MSsplash10-0002-9000000000-9f9b622741790d3c52db
LC-MS/MS Spectrum - LC-ESI-QQ , negativeLC-MS/MSsplash10-0002-9000000000-fd1035e37d1cc077b72a
LC-MS/MS Spectrum - LC-ESI-QQ , negativeLC-MS/MSsplash10-0005-9000000000-9154f606bafc62e4d44f
LC-MS/MS Spectrum - LC-ESI-QQ , negativeLC-MS/MSsplash10-0006-9000000000-2e59d1daee2d53691650
LC-MS/MS Spectrum - LC-ESI-QQ , negativeLC-MS/MSsplash10-0006-9000000000-0c5a3e74046df707c832
Predicted MS/MS Spectrum - 10V, Positive (Annotated)Predicted LC-MS/MSsplash10-0udi-7900000000-f5870b95bbfd354aadb0
Predicted MS/MS Spectrum - 10V, Negative (Annotated)Predicted LC-MS/MSsplash10-0002-9000000000-c730a3695372afafa6b5
Predicted MS/MS Spectrum - 20V, Positive (Annotated)Predicted LC-MS/MSsplash10-0019-9000000000-010ec9b5d84aab1cb000
Predicted MS/MS Spectrum - 20V, Negative (Annotated)Predicted LC-MS/MSsplash10-0007-9000000000-1fb985440564f31980e6
Predicted MS/MS Spectrum - 40V, Positive (Annotated)Predicted LC-MS/MSsplash10-0f76-9000000000-f3792955c5ff67843851
Predicted MS/MS Spectrum - 40V, Negative (Annotated)Predicted LC-MS/MSsplash10-0006-9000000000-f83b4f6fd46bfabbb919
Predicted 1H NMR Spectrum1D NMRNot Applicable
Predicted 13C NMR Spectrum1D NMRNot Applicable
Chromatographic Properties
Collision Cross Sections (CCS)
AdductCCS Value (Å2)Source typeSource
[M-H]-111.5414088
predicted
DarkChem Lite v0.1.0
[M-H]-111.6425088
predicted
DarkChem Lite v0.1.0
[M-H]-122.86641
predicted
DeepCCS 1.0 (2019)
[M+H]+112.3688088
predicted
DarkChem Lite v0.1.0
[M+H]+112.1852088
predicted
DarkChem Lite v0.1.0
[M+H]+124.76183
predicted
DeepCCS 1.0 (2019)
[M+Na]+111.8333088
predicted
DarkChem Lite v0.1.0
[M+Na]+111.7705088
predicted
DarkChem Lite v0.1.0
[M+Na]+132.92651
predicted
DeepCCS 1.0 (2019)

Drug created at June 23, 2017 20:40 / Updated at June 12, 2020 16:53