Chemical ID: 6300070

c1c(nn(c1C(F)F)CC(=O)NN2CCOCC2)C(F)F
Chemical ID:
6300070
Name [?]:
2-[3,5-bis(difluoromethyl)pyrazol-1-yl]-N-morpholino-acetamide
SMILES [?]:
c1c(nn(c1C(F)F)CC(=O)NN2CCOCC2)C(F)F
InChi [?]:
InChI=1/C11H14F4N4O2/c12-10(13)7-5-8(11(14)15)19(16-7)6-9(20)17-18-1-3-21-4-2-18/h5,10-11H,1-4,6H2,(H,17,20)
InChi Info:
AuxInfo=1/1/N:14,18,15,17,1,9,2,5,10,19,6,20,21,7,8,3,12,13,4,11,16/E:(1,2)(3,4)(12,13)(14,15)/rA:21nCCNNCCFFCCONNCCOCCCFF/rB:s1;d2;s3;d1s4;s5;s6;s6;s4;s9;d10;s10;s12;s13;s14;s15;s16;s13s17;s2;s19;s19;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H14F4N4O2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:3.34737
Area:462.2
Solvation:-8.20763
Coulombic:-49.6419
Bond Count [?]
All:22
Single:19
Double:3
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:310.248
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:0.28
LogP (Chemaxon):-0.85

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