Chemical ID: 4770936

CC(C)(C)C(=O)NC(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F
Chemical ID:
4770936
Name [?]:
N-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-2,2-dimethyl-propanamide
SMILES [?]:
CC(C)(C)C(=O)NC(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F
InChi [?]:
InChI=1/C14H14F6N2O2/c1-12(2,3)10(23)22-11(24)21-9-5-7(13(15,16)17)4-8(6-9)14(18,19)20/h4-6H,1-3H3,(H2,21,22,23,24)
InChi Info:
AuxInfo=1/1/N:1,3,4,14,12,16,13,15,11,5,8,2,21,17,22,23,24,18,19,20,10,7,6,9/E:(1,2,3)(5,6)(7,8)(13,14)(15,16,17,18,19,20)/rA:24nCCCCCONCONCCCCCCCFFFCFFF/rB:s1;s2;s2;s2;d5;s5;s7;d8;s8;s10;s11;d12;s13;d14;d11s15;s15;s17;s17;s17;s13;s21;s21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H14F6N2O2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:7.32949
Area:499.102
Solvation:-5.14805
Coulombic:-77.2125
Bond Count [?]
All:24
Single:19
Double:5
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:356.264
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:4.39
LogP (Chemaxon):4.72

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