Chemical ID: 4681417

c1ccc(cc1)CN(Cc2ccccc2)C(=O)C(F)(F)F
Chemical ID:
4681417
Name [?]:
N,N-dibenzyl-2,2,2-trifluoro-acetamide
SMILES [?]:
c1ccc(cc1)CN(Cc2ccccc2)C(=O)C(F)(F)F
InChi [?]:
InChI=1/C16H14F3NO/c17-16(18,19)15(21)20(11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14/h1-10H,11-12H2
InChi Info:
AuxInfo=1/0/N:1,13,2,6,12,14,3,5,11,15,7,9,4,10,16,18,19,20,21,8,17/E:(1,2)(3,4,5,6)(7,8,9,10)(11,12)(13,14)(17,18,19)/rA:21nCCCCCCCNCCCCCCCCOCFFF/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;d11;s12;d13;d10s14;s8;d16;s16;s18;s18;s18;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H14F3NO
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.25558
Area:449.121
Solvation:-1.97244
Coulombic:-42.8221
Bond Count [?]
All:22
Single:15
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:293.284
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.97
LogP (Chemaxon):4.12

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Descriptor Annotations

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