Chemical ID: 4487735

CN(C)CCNC(=O)C(=O)Nc1cccc(c1)C(F)(F)F
Chemical ID:
4487735
Name [?]:
N-(2-dimethylaminoethyl)-N'-[3-(trifluoromethyl)phenyl]-oxamide
SMILES [?]:
CN(C)CCNC(=O)C(=O)Nc1cccc(c1)C(F)(F)F
InChi [?]:
InChI=1/C13H16F3N3O2/c1-19(2)7-6-17-11(20)12(21)18-10-5-3-4-9(8-10)13(14,15)16/h3-5,8H,6-7H2,1-2H3,(H,17,20)(H,18,21)
InChi Info:
AuxInfo=1/1/N:1,3,14,15,13,5,4,17,16,12,7,9,18,19,20,21,6,11,2,8,10/E:(1,2)(14,15,16)/rA:21nCNCCCNCOCONCCCCCCCFFF/rB:s1;s2;s2;s4;s5;s6;d7;s7;d9;s9;s11;s12;d13;s14;d15;d12s16;s16;s18;s18;s18;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H16F3N3O2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.38652
Area:491.912
Solvation:-2.91127
Coulombic:-69.9756
Bond Count [?]
All:21
Single:16
Double:5
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:303.28
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:1.24
LogP (Chemaxon):1.23

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