General Information of the Compound
| Compound ID |
CP0228182
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| Compound Name |
(+/-)2-Benzo[1,3]dioxol-5-yl-1-methyl-ethylamine
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| Synonyms |
1,3-Benzodioxole-5-ethanamine, alpha-methyl-
1-(1,3-benzodioxol-5-yl)propan-2-amine
3,4-Methylenedioxy-amphetamine
3,4-methylenedioxyamphetamine
4764-17-4
5-19-08-00417 (Beilstein Handbook Reference)
AI3-24882
ALPHA-METHYL-3,4-(METHYLENEDIOXY)PHENETHYLAMINE
BRN 0150196
CHEMBL6731
DEA No. 7400
MDA (pharmaceutical)
METHYLENEDIOXYAMPHETAMINE
Methylenedioxyamphetamine
NGBBVGZWCFBOGO-UHFFFAOYSA-N
Phenethylamine, alp
Tenamfetamina [Spanish]
Tenamfetamine
Tenamfetamine [INN]
Tenamfetaminum [Latin]
alpha-Methyl-1,3-benzodioxole-5-ethanamine
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| Structure |
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| Formula |
C10H13NO2
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| Molecular Weight |
179.219
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| Canonical SMILES |
CC(N)Cc1ccc2OCOc2c1
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| InChI |
InChI=1S/C10H13NO2/c1-7(11)4-8-2-3-9-10(5-8)13-6-12-9/h2-3,5,7H,4,6,11H2,1H3
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| InChIKey |
NGBBVGZWCFBOGO-UHFFFAOYSA-N
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| CAS |
4764-17-4
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT00884, Sodium-dependent dopamine transporter
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter
Protein ID: PT00891, Sodium-dependent serotonin transporter
Cell Viability or Cytotoxicity Assay
| Cell Line ID | Cell Line Name | Cell Line Organism | |
| CL000004 | SH-SY5Y | Homo sapiens (Human) | 1 |
| 1 |
EC50 > 10000000 nM
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Clinical Information about the Compound