Chemical ID: 4155124

Cc1ccc(cc1)OCCCC(=O)Nc2ccc(cc2)F
Chemical ID:
4155124
Name [?]:
N-(4-fluorophenyl)-4-(4-methylphenoxy)-butanamide
SMILES [?]:
Cc1ccc(cc1)OCCCC(=O)Nc2ccc(cc2)F
InChi [?]:
InChI=1/C17H18FNO2/c1-13-4-10-16(11-5-13)21-12-2-3-17(20)19-15-8-6-14(18)7-9-15/h4-11H,2-3,12H2,1H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,10,11,3,7,17,19,16,20,4,6,9,2,18,15,5,12,21,14,13,8/E:(4,5)(6,7)(8,9)(10,11)/rA:21nCCCCCCCOCCCCONCCCCCCF/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;s18;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18FNO2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:8.10258
Area:503.135
Solvation:-4.47581
Coulombic:-31.3723
Bond Count [?]
All:22
Single:15
Double:7
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:287.329
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.79
LogP (Chemaxon):3.92

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