Chemical ID: 4276407

c1ccc(cc1)CNC(=O)c2cccc(c2)F
Chemical ID:
4276407
Name [?]:
N-benzyl-3-fluoro-benzamide
SMILES [?]:
c1ccc(cc1)CNC(=O)c2cccc(c2)F
InChi [?]:
InChI=1/C14H12FNO/c15-13-8-4-7-12(9-13)14(17)16-10-11-5-2-1-3-6-11/h1-9H,10H2,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,2,6,13,3,5,12,14,16,7,4,11,15,9,17,8,10/E:(2,3)(5,6)/rA:17nCCCCCCCNCOCCCCCCF/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s9;s11;d12;s13;d14;d11s15;s15;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H12FNO
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:7.85525
Area:417.207
Solvation:-2.57492
Coulombic:-27.8265
Bond Count [?]
All:18
Single:11
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:229.25
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.3
LogP (Chemaxon):2.86

Name Annotations

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Descriptor Annotations

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