Home Amines 1021426-42-5
1021426-42-5,MFCD19174778
Catalog No.:AA0006NF
1021426-42-5 | 1-(4-(4-Amino-3-methoxyphenyl)piperazin-1-yl)ethanone
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1g
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$46.00   $32.00
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Technical Information
Catalog Number:
AA0006NF
Chemical Name:
1-(4-(4-Amino-3-methoxyphenyl)piperazin-1-yl)ethanone
CAS Number:
1021426-42-5
Molecular Formula:
C13H19N3O2
Molecular Weight:
249.3089
MDL Number:
MFCD19174778
IUPAC Name:
1-[4-(4-amino-3-methoxyphenyl)piperazin-1-yl]ethanone
InChI:
InChI=1S/C13H19N3O2/c1-10(17)15-5-7-16(8-6-15)11-3-4-12(14)13(9-11)18-2/h3-4,9H,5-8,14H2,1-2H3
InChI Key:
OJCNMAFGNSFBOO-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1N)N1CCN(CC1)C(=O)C
UNII:
23HOW335J0
Properties
Computed Properties
 
Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.148g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
249.314g/mol
Monoisotopic Mass:
249.148g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

Synonyms
 
1021426-42-5 
1-(4-(4-amino-3-methoxyphenyl)piperazin-1-yl)ethanone 
2-Methoxy-4-(4-acetylpiperazin-1-yl)benzenamine 
SCHEMBL2205957 
OJCNMAFGNSFBOO-UHFFFAOYSA-N 
MFCD19174778 
ZINC77427968 
AKOS006253772 
IMED1147301539 
SB17742 
AC-30109 
AK173644 
1-[4-(4-amino-3-methoxyphenyl)piperazin-1-yl]ethan-1-one 
AS-36441 
SY099615 
CS-0052675 
MFCD19174778 (95%) 
1-(4-(4-amino-3-methoxy phenyl)piperazin-1-yl)ethanone 
Ethanone, 1-[4-(4-amino-3-methoxyphenyl)-1-piperazinyl]- 
ACN-046345 
1-[4-(4-Amino-3-methoxy-phenyl)-piperazin-1-yl]-ethanone 
UNII-23HOW335J0 
4-(4-acetyl-1-piperazinyl)-2-(methyloxy)aniline 
23HOW335J0 
1-[4-(4-Amino-3-methoxyphenyl)-1-piperazinyl]ethanone 
1-[4-(4-amino-3-methoxyphenyl)piperazin-1-yl]ethanone 
1-(4-(4-amino-3-methoxyphenyl)piperazin-1-yl)ethan-1-one 
2-methoxy-4-(N-acetyl-piperazin-1-yl)aniline 
Literature
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