Chemical ID: 6032362

Cc1cc(c(o1)C)C(=O)N(CCC(=O)NCc2ccc(cc2)F)C3CC3
Chemical ID:
6032362
Name [?]:
N-cyclopropyl-N-[2-[(4-fluorophenyl)methylcarbamoyl]ethyl]-2,5-dimethyl-furan-3-carboxamide
SMILES [?]:
Cc1cc(c(o1)C)C(=O)N(CCC(=O)NCc2ccc(cc2)F)C3CC3
InChi [?]:
InChI=1/C20H23FN2O3/c1-13-11-18(14(2)26-13)20(25)23(17-7-8-17)10-9-19(24)22-12-15-3-5-16(21)6-4-15/h3-6,11,17H,7-10,12H2,1-2H3,(H,22,24)
InChi Info:
AuxInfo=1/1/N:1,7,18,22,19,21,25,26,12,11,3,16,2,5,17,20,24,4,13,8,23,15,10,14,9,6/E:(3,4)(5,6)(7,8)/rA:26nCCCCCOCCONCCCONCCCCCCCFCCC/rB:s1;d2;s3;d4;s2s5;s5;s4;d8;s8;s10;s11;s12;d13;s13;s15;s16;s17;d18;s19;d20;d17s21;s20;s10;s24;s24s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H23FN2O3
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:10.0753
Area:574.493
Solvation:-4.28702
Coulombic:-47.4084
Bond Count [?]
All:28
Single:21
Double:7
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:358.407
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.39
LogP (Chemaxon):1.82

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Descriptor Annotations

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