Chemical ID: 5522061

c1ccc(cc1)CNC(=O)c2ccc(cc2)C(F)(F)F
Chemical ID:
5522061
Name [?]:
N-benzyl-4-(trifluoromethyl)benzamide
SMILES [?]:
c1ccc(cc1)CNC(=O)c2ccc(cc2)C(F)(F)F
InChi [?]:
InChI=1/C15H12F3NO/c16-15(17,18)13-8-6-12(7-9-13)14(20)19-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,12,16,13,15,7,4,11,14,9,17,18,19,20,8,10/E:(2,3)(4,5)(6,7)(8,9)(16,17,18)/rA:20nCCCCCCCNCOCCCCCCCFFF/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s9;s11;d12;s13;d14;d11s15;s14;s17;s17;s17;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H12F3NO
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.87581
Area:455.224
Solvation:-2.50479
Coulombic:-43.1809
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:279.257
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.06
LogP (Chemaxon):3.6

Name Annotations

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Descriptor Annotations

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