Chemical ID: 7324402

c1cc(ccc1C(F)(F)F)OCC(=O)NC(=O)N
Chemical ID:
7324402
Name [?]:
N-carbamoyl-2-[4-(trifluoromethyl)phenoxy]-acetamide
SMILES [?]:
c1cc(ccc1C(F)(F)F)OCC(=O)NC(=O)N
InChi [?]:
InChI=1/C10H9F3N2O3/c11-10(12,13)6-1-3-7(4-2-6)18-5-8(16)15-9(14)17/h1-4H,5H2,(H3,14,15,16,17)
InChi Info:
AuxInfo=1/1/N:1,5,2,4,12,6,3,13,16,7,8,9,10,18,15,14,17,11/E:(1,2)(3,4)(11,12,13)/rA:18nCCCCCCCFFFOCCONCON/rB:s1;d2;s3;d4;d1s5;s6;s7;s7;s7;s3;s11;s12;d13;s13;s15;d16;s16;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H9F3N2O3
All Atoms:27
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:3.66526
Area:417.24
Solvation:-6.76573
Coulombic:-70.0042
Bond Count [?]
All:18
Single:13
Double:5
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:262.185
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:1.61
LogP (Chemaxon):1.08

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Descriptor Annotations

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