Chemical ID: 6150063

CCCC(=O)Nc1cc(ccc1N2CCOCC2)C(F)(F)F
Chemical ID:
6150063
Name [?]:
N-[2-morpholino-5-(trifluoromethyl)phenyl]butanamide
SMILES [?]:
CCCC(=O)Nc1cc(ccc1N2CCOCC2)C(F)(F)F
InChi [?]:
InChI=1/C15H19F3N2O2/c1-2-3-14(21)19-12-10-11(15(16,17)18)4-5-13(12)20-6-8-22-9-7-20/h4-5,10H,2-3,6-9H2,1H3,(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,2,3,10,11,14,18,15,17,8,9,7,12,4,19,20,21,22,6,13,5,16/E:(6,7)(8,9)(16,17,18)/rA:22nCCCCONCCCCCCNCCOCCCFFF/rB:s1;s2;s3;d4;s4;s6;s7;d8;s9;d10;d7s11;s12;s13;s14;s15;s16;s13s17;s9;s19;s19;s19;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H19F3N2O2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.09563
Area:486.107
Solvation:-4.05704
Coulombic:-53.2427
Bond Count [?]
All:23
Single:19
Double:4
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:316.319
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.83
LogP (Chemaxon):3.2

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Descriptor Annotations

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