Home Amines 1015845-57-4
1015845-57-4,MFCD08691489
Catalog No.:AA0004RG
1015845-57-4 | N-[(1-Ethyl-3,5-dimethyl-1h-pyrazol-4-yl)methyl]-n-(2-methoxyethyl)amine
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Technical Information
Catalog Number:
AA0004RG
Chemical Name:
N-[(1-Ethyl-3,5-dimethyl-1h-pyrazol-4-yl)methyl]-n-(2-methoxyethyl)amine
CAS Number:
1015845-57-4
Molecular Formula:
C11H21N3O
Molecular Weight:
211.3039
MDL Number:
MFCD08691489
IUPAC Name:
N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-2-methoxyethanamine
InChI:
InChI=1S/C11H21N3O/c1-5-14-10(3)11(9(2)13-14)8-12-6-7-15-4/h12H,5-8H2,1-4H3
InChI Key:
ZNINVYRZRSLENF-UHFFFAOYSA-N
SMILES:
COCCNCc1c(C)nn(c1C)CC
Properties
Computed Properties
 
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.168g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.309g/mol
Monoisotopic Mass:
211.168g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
39.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

Synonyms
 
1015845-57-4 
N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-(2-methoxyethyl)amine 
SBB046585 
STK502234 
ZINC19089146 
AKOS000321544 
MCULE-9430808353 
AJ-71130 
BB 0240876 
Y-4178 
(1-Ethyl-3,5-dimethyl-1H-pyrazol-4-ylmethyl)-( 2-methoxy-ethyl)-amine 
(1-Ethyl-3,5-dimethyl-1H-pyrazol-4-ylmethyl)-(2-methoxyethyl)amine 
N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-methoxyethanamine 
1H-Pyrazole-4-methanamine, 1-ethyl-N-(2-methoxyethyl)-3,5-dimethyl- 
N-[(1-Ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-methoxyethan-1-amine 
C11H21N3O 
[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl](2-methoxyethyl)amine 
N-((1-Ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl)-2-methoxyethanamine 
CTK3J9926 
DTXSID10649166 
ALBB-000332 
7379AC 
MFCD08691489 
Literature
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