Chemical ID: 6672464

Cc1cc(c(cc1C)NC(=O)c2cccc(c2)F)C
Chemical ID:
6672464
Name [?]:
3-fluoro-N-(2,4,5-trimethylphenyl)-benzamide
SMILES [?]:
Cc1cc(c(cc1C)NC(=O)c2cccc(c2)F)C
InChi [?]:
InChI=1/C16H16FNO/c1-10-7-12(3)15(8-11(10)2)18-16(19)13-5-4-6-14(17)9-13/h4-9H,1-3H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,8,19,14,13,15,3,6,17,2,7,4,12,16,5,10,18,9,11/rA:19nCCCCCCCCNCOCCCCCCFC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;d10;s10;s12;d13;s14;d15;d12s16;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H16FNO
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.47598
Area:444.161
Solvation:-2.62804
Coulombic:-25.9918
Bond Count [?]
All:20
Single:13
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:257.303
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.25
LogP (Chemaxon):3.99

Name Annotations

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Descriptor Annotations

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