Methyl alpha-(aminomethyl)-5-methoxy-1H-indole-3-acetate
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Basic information
- CAS
73758-06-2- Standard SMILES
COC(=O)C(CN)c1c[nH]c2ccc(OC)cc12- InChIKey
YFEDJMLMWJSRJJ-UHFFFAOYSA-N- Molecular formula
- C13H16N2O3
- Average molar mass
- 248.28 g/mol
- Monoisotopic mass
- 248.11609238
Names & identifiers
- Preferred name
- Methyl alpha-(aminomethyl)-5-methoxy-1H-indole-3-acetate
- IUPAC
- methyl 3-amino-2-(5-methoxy-1H-indol-3-yl)propanoate
- English name
- Indorenate
- Molecular formula
- C13H16N2O3
- Molecular weight
- 248.28
Names & synonyms
indorenate73758-06-2IndorenatoIndorenatumAV9L041QA4DTXSID20484001H-Indole-3-acetic acid, alpha-(aminomethyl)-5-methoxy-, methyl ester1H-Indole-3-acetic acid, alpha-(aminomethyl)-5-methoxy-, methyl ester, monohydrochlorideRefChem:925704DTXCID0028373TR3369Methyl alpha-(aminomethyl)-5-methoxy-1H-indole-3-acetate
Show more names
1H-Indole-3-acetic acid, α-(aminomethyl)-5-methoxy-, methyl ester
Indorenate [INN]methyl 3-amino-2-(5-methoxy-1H-indol-3-yl)propanoateIndorenatum [INN-Latin]Indorenato [INN-Spanish]NCGC00161405-01UNII-AV9L041QA4CHEMBL414636SCHEMBL10080621
Database identifiers
- CAS
73758-06-2- PubChem CID
- 71987
- DTXSID
DTXSID2048400- ChEMBL
CHEMBL414636- UNII
- AV9L041QA4
Properties
Computed structural propertiesFilling in
- XLogP
- 0.9
- Topological polar surface area
- 77.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 298
Physicochemical properties
- Boiling point
- 442.8 · 442.8±45.0 °C(Predicted)
- Density
- 1.243 · 1.243±0.06 g/cm3(Predicted)
- pka
- 15.98 · 15.98±0.30(Predicted)
- FDA UNII
- 9 L041QA4 · AV9L041QA4
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Drugs used in the treatment of acute or chronic vascular HYPERTENSION regardless of pharmacological mechanism. Among the antihypertensive agents are DIURETICS; (especially DIURETICS, THIAZIDE); ADRENERGIC BETA-ANTAGONISTS; ADRENERGIC ALPHA-ANTAGONISTS; ANGIOTENSIN-CONVERTING ENZYME INHIBITORS; CALCIUM CHANNEL BLOCKERS; GANGLIONIC BLOCKERS; and VASODILATOR AGENTS.
Agents that alleviate ANXIETY, tension, and ANXIETY DISORDERS, promote sedation, and have a calming effect without affecting clarity of consciousness or neurologic conditions. ADRENERGIC BETA-ANTAGONISTS are commonly used in the symptomatic treatment of anxiety but are not included here.
Endogenous compounds and drugs that bind to and activate SEROTONIN RECEPTORS. Many serotonin receptor agonists are used as ANTIDEPRESSANTS; ANXIOLYTICS; and in the treatment of MIGRAINE DISORDERS.
Related reactions
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Compound notes
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