Chemical ID: 6323304

CC(C)CC(=O)Nc1ccccc1F
Chemical ID:
6323304
Name [?]:
N-(2-fluorophenyl)-3-methyl-butanamide
SMILES [?]:
CC(C)CC(=O)Nc1ccccc1F
InChi [?]:
InChI=1/C11H14FNO/c1-8(2)7-11(14)13-10-6-4-3-5-9(10)12/h3-6,8H,7H2,1-2H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,3,11,10,12,9,4,2,13,8,5,14,7,6/E:(1,2)/rA:14nCCCCCONCCCCCCF/rB:s1;s2;s2;s4;d5;s5;s7;s8;d9;s10;d11;d8s12;s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H14FNO
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.05223
Area:365.929
Solvation:-2.09598
Coulombic:-25.6258
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):2.22

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Descriptor Annotations

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