Home Other Building Blocks rac-[(2R,3R)-4-ethyl-3-(1-methyl-1H-pyrazol-5-yl)morpholin-2-yl]methanamine, trans

rac-[(2R,3R)-4-ethyl-3-(1-methyl-1H-pyrazol-5-yl)morpholin-2-yl]methanamine, trans

CAS No.:
2059908-65-3
Catalog Number:
AG01BRQF
Molecular Formula:
C11H20N4O
Molecular Weight:
224.3027
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Product Description
Catalog Number:
AG01BRQF
Chemical Name:
rac-[(2R,3R)-4-ethyl-3-(1-methyl-1H-pyrazol-5-yl)morpholin-2-yl]methanamine, trans
CAS Number:
2059908-65-3
Molecular Formula:
C11H20N4O
Molecular Weight:
224.3027
MDL Number:
MFCD30535864
IUPAC Name:
[(2S,3S)-4-ethyl-3-(2-methylpyrazol-3-yl)morpholin-2-yl]methanamine
InChI:
InChI=1S/C11H20N4O/c1-3-15-6-7-16-10(8-12)11(15)9-4-5-13-14(9)2/h4-5,10-11H,3,6-8,12H2,1-2H3/t10-,11-/m0/s1
InChI Key:
JLOMQUHWLWSDDO-QWRGUYRKSA-N
SMILES:
NC[C@@H]1OCCN([C@H]1c1ccnn1C)CC
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
224.164g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.308g/mol
Monoisotopic Mass:
224.164g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties