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Home Aminos 2-amino-3-phenyl-1-(pyrrolidin-1-yl)propan-1-one

2-amino-3-phenyl-1-(pyrrolidin-1-yl)propan-1-one

CAS No.:
92008-59-8
Catalog Number:
AG01A8H7
Molecular Formula:
C13H18N2O
Molecular Weight:
218.2948
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Product Description
Catalog Number:
AG01A8H7
Chemical Name:
2-amino-3-phenyl-1-(pyrrolidin-1-yl)propan-1-one
CAS Number:
92008-59-8
Molecular Formula:
C13H18N2O
Molecular Weight:
218.2948
MDL Number:
MFCD01474848
IUPAC Name:
2-amino-3-phenyl-1-pyrrolidin-1-ylpropan-1-one
InChI:
InChI=1S/C13H18N2O/c14-12(10-11-6-2-1-3-7-11)13(16)15-8-4-5-9-15/h1-3,6-7,12H,4-5,8-10,14H2
InChI Key:
XJPALNDNNCWDJU-UHFFFAOYSA-N
SMILES:
NC(C(=O)N1CCCC1)Cc1ccccc1
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.142g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.3g/mol
Monoisotopic Mass:
218.142g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Design, synthesis, and SAR of potent and selective dipeptide-derived inhibitors for dipeptidyl peptidases. Journal of medicinal chemistry 20031106
Properties