Chemical ID: 7295918

c1cc(cc(c1)NC(=O)Cc2ccc(cc2)F)C#N
Chemical ID:
7295918
Name [?]:
N-(3-cyanophenyl)-2-(4-fluorophenyl)-acetamide
SMILES [?]:
c1cc(cc(c1)NC(=O)Cc2ccc(cc2)F)C#N
InChi [?]:
InChI=1/C15H11FN2O/c16-13-6-4-11(5-7-13)9-15(19)18-14-3-1-2-12(8-14)10-17/h1-8H,9H2,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,2,6,12,16,13,15,4,10,18,11,3,14,5,8,17,19,7,9/E:(4,5)(6,7)/rA:19nCCCCCCNCOCCCCCCCFCN/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;s10;s11;d12;s13;d14;d11s15;s14;s3;t18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H11FN2O
All Atoms:30
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.64883
Area:449.593
Solvation:-3.591
Coulombic:-27.7354
Bond Count [?]
All:20
Single:12
Double:7
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:254.259
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.69
LogP (Chemaxon):3.17

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