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13674-05-0 molecular structure
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1-(7-methoxy-2H-1,3-benzodioxol-5-yl)propan-2-amine

ChemBase ID: 1249
Molecular Formular: C11H15NO3
Molecular Mass: 209.2417
Monoisotopic Mass: 209.10519335
SMILES and InChIs

SMILES:
O1c2cc(CC(N)C)cc(OC)c2OC1
Canonical SMILES:
COc1cc(CC(N)C)cc2c1OCO2
InChI:
InChI=1S/C11H15NO3/c1-7(12)3-8-4-9(13-2)11-10(5-8)14-6-15-11/h4-5,7H,3,6,12H2,1-2H3
InChIKey:
YQYUWUKDEVZFDB-UHFFFAOYSA-N

Cite this record

CBID:1249 http://www.chembase.cn/molecule-1249.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
1-(7-methoxy-2H-1,3-benzodioxol-5-yl)propan-2-amine
IUPAC Traditional name
mmda (drug)
MMDA
Synonyms
(+-)-mmda
3-METHOXY-METHYLENEDIOXYAMPHETAMINE
3-Methoxy-4,5-methylenedioxyphenylisopropylamine
3-Methoxy-alpha-methyl-4,5-methylenedioxyphenethylamine
Amphetamine, 3,4-methylenedioxy-5-methoxy
5-Methoxy-3,4-methylenedioxyamphetamine
DEA No. 7401
MMDA
MMDA (drug)
CAS Number
13674-05-0
PubChem SID
160964709
46506802
PubChem CID
26175
Chemspider ID
24386
Wikipedia Title
MMDA_(drug)

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem ALOGPS 2.1
H Acceptors H Donor
LogD (pH = 5.5) -1.7484035  LogD (pH = 7.4) -1.1874633 
Log P 1.2698127  Molar Refractivity 55.9353 cm3
Polarizability 22.289127 Å3 Polar Surface Area 53.71 Å2
Rotatable Bonds Lipinski's Rule of Five true 
Log P 1.07  LOG S -1.89 
Solubility (Water) 2.71e+00 g/l 

PROPERTIES

PROPERTIES

Pharmacology Properties Bioassay(PubChem)
Admin Routes
Oral, Insufflation, Rectal expand Show data source
Legal Status
Schedule I (US) expand Show data source

DETAILS

DETAILS

DrugBank DrugBank Wikipedia Wikipedia
DrugBank - DB01442 external link
Item Information
Drug Groups illicit; experimental
Description MMDA, or 3-methoxy-4,5-methylenedioxyamphetamine, is a stimulant and psychedelic drug of the amphetamine class. It also acts as an entheogen and an entactogen. MMDA bears resemblance to the psychopharmacologically active essential oils elemicin and myristicin found in nutmeg. The effects of MMDA includes feelings of euphoria and warmth, as well as realistic closed-eye visuals.
Indication MMDA is a recreational drug. It has no current medical uses and is a Schedule I controlled substance in the USA at present.
Affected Organisms
Humans and other mammals
External Links
Wikipedia

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

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