Iproniazid

Base Information

• Chemical Name: Iproniazid
• CAS No.: 54-92-2
• Molecular Formula: C9H13 N3 O
• Molecular Weight: 179.222
• Hs Code.: 2933399090
• European Community (EC) Number: 200-218-8
• UNII: D892HFI3XA
• DSSTox Substance ID: DTXSID5023168
• Nikkaji Number: J4.158K
• Wikipedia: Iproniazid
• Wikidata: Q421368
• NCI Thesaurus Code: C97714
• Pharos Ligand ID: SX3MTHUHYXNV
• Metabolomics Workbench ID: 67462
• ChEMBL ID: CHEMBL92401
• Mol file: 54-92-2.mol

Synonyms:Iprazid;Iproniazid

Chemical Property of Iproniazid

Chemical Property:

• Melting Point: 112.5-113.5°
• Refractive Index: 1.5100 (estimate)
• Boiling Point: 311.75°C (rough estimate)
• PKA: 11.28±0.23(Predicted)
• PSA: 54.02000
• Density: 1.1305 (rough estimate)
• LogP: 1.50620
• Storage Temp.: Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 179.105862047
• Heavy Atom Count: 13
• Complexity: 164

Purity/Quality:

97% ^*data from raw suppliers

Iproniazid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)NNC(=O)C1=CC=NC=C1
• Recent EU Clinical Trials: Evaluation médico-économique de l’infusion continue intra-duodénale d’une forme gélifiée de levodopa dans le traitement des formes avancées et sévères de maladie de parkinson par l’intermédiaire d’un dispositif médical
• Uses: Iproniazid is a hydrazine based drug used as an antidepressant. Iproniazid acts as an irreversible and nonselective monoamine oxidase inhibitor.
• Therapeutic Function: Antidepressant, Monoamine oxidase inhibitor

Technology Process of Iproniazid

There total 5 articles about Iproniazid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 95.0%

isonicotinic acid isopropylidenehydrazide (4813-04-1) → iproniazid (54-92-2)

Guidance literature:

With hydrogenchloride; sodium cyanoborohydride; In tetrahydrofuran; for 0.5h; Ambient temperature;

Reference yield:

isoniazid (54-85-3,7640-37-1) → iproniazid (54-92-2)

Guidance literature:

Multi-step reaction with 2 steps

2: platinum; ethanol / Hydrogenation

With ethanol; platinum;

DOI:10.1021/ja01104a046

Reference yield:

2-iodo-propane (75-30-9) + isoniazid (54-85-3,7640-37-1) → iproniazid (54-92-2)

Guidance literature:

With methanol;

upstream raw materials:

2-iodo-propane

isoniazid

isopropyl bromide

isonicotinic acid isopropylidenehydrazide

Downstream raw materials:

3-isopropyl-5-pyridin-4-yl-3H-[1,3,4]oxadiazole-2-thione