Home Aminos 3-amino-1-[4-(pyrimidin-2-yl)piperazin-1-yl]propan-1-one

3-amino-1-[4-(pyrimidin-2-yl)piperazin-1-yl]propan-1-one

CAS No.:
938517-21-6
Catalog Number:
AG01A9GR
Molecular Formula:
C11H17N5O
Molecular Weight:
235.2856
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Product Description
Catalog Number:
AG01A9GR
Chemical Name:
3-amino-1-[4-(pyrimidin-2-yl)piperazin-1-yl]propan-1-one
CAS Number:
938517-21-6
Molecular Formula:
C11H17N5O
Molecular Weight:
235.2856
MDL Number:
MFCD09726251
IUPAC Name:
3-amino-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one
InChI:
InChI=1S/C11H17N5O/c12-3-2-10(17)15-6-8-16(9-7-15)11-13-4-1-5-14-11/h1,4-5H,2-3,6-9,12H2
InChI Key:
RFSWMRZTOLMWPQ-UHFFFAOYSA-N
SMILES:
NCCC(=O)N1CCN(CC1)c1ncccn1
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.143g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.291g/mol
Monoisotopic Mass:
235.143g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1  
Properties