Chemical ID: 6299555

c1cc(c(c(c1)F)F)CN2CCNCC2
Chemical ID:
6299555
Name [?]:
1-[(2,3-difluorophenyl)methyl]piperazine
SMILES [?]:
c1cc(c(c(c1)F)F)CN2CCNCC2
InChi [?]:
InChI=1/C11H14F2N2/c12-10-3-1-2-9(11(10)13)8-15-6-4-14-5-7-15/h1-3,14H,4-8H2
InChi Info:
AuxInfo=1/0/N:1,2,6,12,14,11,15,9,3,5,4,7,8,13,10/E:(4,5)(6,7)/rA:15nCCCCCCFFCNCCNCC/rB:s1;d2;s3;d4;d1s5;s5;s4;s3;s9;s10;s11;s12;s13;s10s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H14F2N2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:5.76718
Area:361.315
Solvation:-3.26571
Coulombic:-21.5587
Bond Count [?]
All:16
Single:13
Double:3
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:212.239
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.5
LogP (Chemaxon):1.65

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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