Home Other Building Blocks 1-cyclopropyl-2-(3,4-difluorophenyl)-5-oxopyrrolidine-3-carboxamide, trans

1-cyclopropyl-2-(3,4-difluorophenyl)-5-oxopyrrolidine-3-carboxamide, trans

CAS No.:
1820579-97-2
Catalog Number:
AG01BGY2
Molecular Formula:
C14H14F2N2O2
Molecular Weight:
280.2700
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Product Description
Catalog Number:
AG01BGY2
Chemical Name:
1-cyclopropyl-2-(3,4-difluorophenyl)-5-oxopyrrolidine-3-carboxamide, trans
CAS Number:
1820579-97-2
Molecular Formula:
C14H14F2N2O2
Molecular Weight:
280.2700
MDL Number:
MFCD28657111
IUPAC Name:
(2R,3R)-1-cyclopropyl-2-(3,4-difluorophenyl)-5-oxopyrrolidine-3-carboxamide
InChI:
InChI=1S/C14H14F2N2O2/c15-10-4-1-7(5-11(10)16)13-9(14(17)20)6-12(19)18(13)8-2-3-8/h1,4-5,8-9,13H,2-3,6H2,(H2,17,20)/t9-,13+/m1/s1
InChI Key:
NEOPBLGLWMZELZ-RNCFNFMXSA-N
SMILES:
NC(=O)[C@@H]1CC(=O)N([C@H]1c1ccc(c(c1)F)F)C1CC1
Properties
Complexity:
427  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
280.102g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
280.275g/mol
Monoisotopic Mass:
280.102g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties