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(2S)-5-{4-[(2-fluorophenyl)methoxy]phenyl}pyrrolidine-2-carboxamide

(2S)-5-{4-[(2-fluorophenyl)methoxy]phenyl}pyrrolidine-2-carboxamide

Formula: C18H19FN2O2

SMILES: NC(=O)[C@@H]1CCC(N1)C1=CC=C(OCC2=CC=CC=C2F)C=C1

IUPAC: (2S)-5-{4-[(2-fluorophenyl)methoxy]phenyl}pyrrolidine-2-carboxamide

InChI: InChI=1S/C18H19FN2O2/c19-15-4-2-1-3-13(15)11-23-14-7-5-12(6-8-14)16-9-10-17(21-16)18(20)22/h1-8,16-17,21H,9-11H2,(H2,20,22)/t16?,17-/m0/s1

Composition: C (68.77%), H (6.09%), F (6.04%), N (8.91%), O (10.18%)

Molar Mass: 314.36

Atom Count: 42

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 2
Exact Mass 314.143056023
Formal Charge 0
FSP3 0.28
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey JESCETIFNOFKEU-DJNXLDHESA-N
Lipinski's Rule of Five 1
Molar Refractivity 85.46
Topological Polar Surface Area 64.35
Polarizability 33.3
Ring Count 3
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
LabNetwork INC
Purity LeadTime Formula PacketSize UnitPrice
95% 1 Day C18H19FN2O2 $748.44-$2,653.56$748.44$1,326.78$2,653.56
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