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N-Methyl-1-(3,4-methylenedioxyphenyl)-2-butanamine

N-Methyl-1-(3,4-methylenedioxyphenyl)-2-butanamine structure

CAS No:
135795-90-3
Formula:
C12H17NO2
Chemical Name:
N-Methyl-1-(3,4-methylenedioxyphenyl)-2-butanamine
Synonyms:
1,3-Benzodioxole-5-ethanamine,α-ethyl-N-methyl-;α-Ethyl-N-methyl-1,3-benzodioxole-5-ethanamine;N-Methyl-1-(1,3-benzodioxol-5-yl)-2-aminobutane;N-Methyl-1-(3,4-methylenedioxyphenyl)-2-butanamine;N-Methyl-1-(1,3-benzodioxol-5-yl)-2-butylamine;MBDB;MDBD;[1-(2H-1,3-Benzodioxol-5-yl)butan-2-yl](methyl)amine;103818-46-8
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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N-Methyl-1-(3,4-methylenedioxyphenyl)-2-butanamine Basic Attributes

Molecular Weight：

207.27 g/mol

Exact Mass：

207.27

Characteristics

PSA：

30.5 Å²

Collision Cross Section：

148.4 Å² [M+H]+ [CCS Type: TW, Method: Major Mix IMS/Tof Calibration Kit (Waters)]|148.37 Å² [M+H]+

Drug Information

MeSH Entry Terms：

MBDB

Computed Properties

Molecular Weight:207.27
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:207.125928785
Monoisotopic Mass:207.125928785
Topological Polar Surface Area:30.5
Heavy Atom Count:15
Complexity:198
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-Methyl-1-(3,4-methylenedioxyphenyl)-2-butanamine

Basic Attributes
Characteristics
Drug Information
Computed Properties
Latest News
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