Chemical ID: 6323345

CC(C)CC(=O)Nc1ccc(cc1)F
Chemical ID:
6323345
Name [?]:
N-(4-fluorophenyl)-3-methyl-butanamide
SMILES [?]:
CC(C)CC(=O)Nc1ccc(cc1)F
InChi [?]:
InChI=1/C11H14FNO/c1-8(2)7-11(14)13-10-5-3-9(12)4-6-10/h3-6,8H,7H2,1-2H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,3,10,12,9,13,4,2,11,8,5,14,7,6/E:(1,2)(3,4)(5,6)/rA:14nCCCCCONCCCCCCF/rB:s1;s2;s2;s4;d5;s5;s7;s8;d9;s10;d11;d8s12;s11;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H14FNO
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.7132
Area:367.795
Solvation:-2.48169
Coulombic:-24.2624
Bond Count [?]
All:14
Single:10
Double:4
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:195.233
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.77
LogP (Chemaxon):2.87

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