Chemical ID: 7264113

Cc1cccc(c1)C(=O)NCCC(=O)Nc2ccc(cc2)C(F)(F)F
Chemical ID:
7264113
Name [?]:
3-methyl-N-[2-[[4-(trifluoromethyl)phenyl]carbamoyl]ethyl]benzamide
SMILES [?]:
Cc1cccc(c1)C(=O)NCCC(=O)Nc2ccc(cc2)C(F)(F)F
InChi [?]:
InChI=1/C18H17F3N2O2/c1-12-3-2-4-13(11-12)17(25)22-10-9-16(24)23-15-7-5-14(6-8-15)18(19,20)21/h2-8,11H,9-10H2,1H3,(H,22,25)(H,23,24)
InChi Info:
AuxInfo=1/1/N:1,4,3,5,18,20,17,21,12,11,7,2,6,19,16,13,8,22,23,24,25,10,15,14,9/E:(5,6)(7,8)(19,20,21)/rA:25nCCCCCCCCONCCCONCCCCCCCFFF/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s8;s10;s11;s12;d13;s13;s15;s16;d17;s18;d19;d16s20;s19;s22;s22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H17F3N2O2
All Atoms:42
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:9.93086
Area:555.875
Solvation:-3.96601
Coulombic:-61.034
Bond Count [?]
All:26
Single:18
Double:8
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:350.335
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.69
LogP (Chemaxon):3.56

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