Chemical ID: 7269585

c1cc(cc(c1)OCC(=O)Nc2ccc(cc2)F)C#N
Chemical ID:
7269585
Name [?]:
2-(3-cyanophenoxy)-N-(4-fluorophenyl)-acetamide
SMILES [?]:
c1cc(cc(c1)OCC(=O)Nc2ccc(cc2)F)C#N
InChi [?]:
InChI=1/C15H11FN2O2/c16-12-4-6-13(7-5-12)18-15(19)10-20-14-3-1-2-11(8-14)9-17/h1-8H,10H2,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,2,6,14,16,13,17,4,19,8,3,15,12,5,9,18,20,11,10,7/E:(4,5)(6,7)/rA:20nCCCCCCOCCONCCCCCCFCN/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;d9;s9;s11;s12;d13;s14;d15;d12s16;s15;s3;t19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H11FN2O2
All Atoms:31
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:6.51619
Area:472.704
Solvation:-5.30142
Coulombic:-34.6126
Bond Count [?]
All:21
Single:13
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:270.259
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.56
LogP (Chemaxon):2.83

Name Annotations

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Descriptor Annotations

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