Chemical ID: 6036972

CC(C)CNC(=O)CCN(Cc1ccc(cc1)F)C(=O)c2ccoc2
Chemical ID:
6036972
Name [?]:
N-[(4-fluorophenyl)methyl]-N-[2-(isobutylcarbamoyl)ethyl]furan-3-carboxamide
SMILES [?]:
CC(C)CNC(=O)CCN(Cc1ccc(cc1)F)C(=O)c2ccoc2
InChi [?]:
InChI=1/C19H23FN2O3/c1-14(2)11-21-18(23)7-9-22(19(24)16-8-10-25-13-16)12-15-3-5-17(20)6-4-15/h3-6,8,10,13-14H,7,9,11-12H2,1-2H3,(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,3,13,17,14,16,8,22,9,23,4,11,25,2,12,21,15,6,19,18,5,10,7,20,24/E:(1,2)(3,4)(5,6)/rA:25nCCCCNCOCCNCCCCCCCFCOCCCOC/rB:s1;s2;s2;s4;s5;d6;s6;s8;s9;s10;s11;s12;d13;s14;d15;d12s16;s15;s10;d19;s19;s21;d22;s23;d21s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H23FN2O3
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:9.56785
Area:566.69
Solvation:-4.59941
Coulombic:-48.3131
Bond Count [?]
All:26
Single:19
Double:7
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:346.396
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.45
LogP (Chemaxon):2.61

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