Home Aminos rac-(5R,6R)-5-amino-6-(1-methyl-1H-imidazol-5-yl)-1-propylpiperidin-2-one, trans

rac-(5R,6R)-5-amino-6-(1-methyl-1H-imidazol-5-yl)-1-propylpiperidin-2-one, trans

CAS No.:
1807895-93-7
Catalog Number:
AG01BIZA
Molecular Formula:
C12H20N4O
Molecular Weight:
236.3134
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BIZA
Chemical Name:
rac-(5R,6R)-5-amino-6-(1-methyl-1H-imidazol-5-yl)-1-propylpiperidin-2-one, trans
CAS Number:
1807895-93-7
Molecular Formula:
C12H20N4O
Molecular Weight:
236.3134
MDL Number:
MFCD28118864
IUPAC Name:
(5S,6R)-5-amino-6-(3-methylimidazol-4-yl)-1-propylpiperidin-2-one
InChI:
InChI=1S/C12H20N4O/c1-3-6-16-11(17)5-4-9(13)12(16)10-7-14-8-15(10)2/h7-9,12H,3-6,13H2,1-2H3/t9-,12+/m0/s1
InChI Key:
KYQPKRFMRALAID-JOYOIKCWSA-N
SMILES:
CCCN1C(=O)CC[C@@H]([C@H]1c1cncn1C)N
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
236.164g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.319g/mol
Monoisotopic Mass:
236.164g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties