Chemical ID: 6611900

CC(=O)c1cccc(c1)NC(=O)COc2ccc(cc2)F
Chemical ID:
6611900
Name [?]:
N-(3-acetylphenyl)-2-(4-fluorophenoxy)-acetamide
SMILES [?]:
CC(=O)c1cccc(c1)NC(=O)COc2ccc(cc2)F
InChi [?]:
InChI=1/C16H14FNO3/c1-11(19)12-3-2-4-14(9-12)18-16(20)10-21-15-7-5-13(17)6-8-15/h2-9H,10H2,1H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,6,5,7,17,19,16,20,9,13,2,4,18,8,15,11,21,10,3,12,14/E:(5,6)(7,8)/rA:21nCCOCCCCCCNCOCOCCCCCCF/rB:s1;d2;s2;s4;d5;s6;d7;d4s8;s8;s10;d11;s11;s13;s14;s15;d16;s17;d18;d15s19;s18;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H14FNO3
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:5.75531
Area:485.182
Solvation:-6.37424
Coulombic:-37.9988
Bond Count [?]
All:22
Single:14
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:287.286
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.68
LogP (Chemaxon):2.32

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue