Chemical ID: 5186615

c1ccc(c(c1)CNCc2ccc(cc2)F)F
Chemical ID:
5186615
Name [?]:
1-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]methanamine
SMILES [?]:
c1ccc(c(c1)CNCc2ccc(cc2)F)F
InChi [?]:
InChI=1/C14H13F2N/c15-13-7-5-11(6-8-13)9-17-10-12-3-1-2-4-14(12)16/h1-8,17H,9-10H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,11,15,12,14,9,7,10,5,13,4,16,17,8/E:(5,6)(7,8)/rA:17nCCCCCCCNCCCCCCCFF/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;s9;s10;d11;s12;d13;d10s14;s13;s4;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H13F2N
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:7.47111
Area:414.067
Solvation:-2.88056
Coulombic:-18.9263
Bond Count [?]
All:18
Single:12
Double:6
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:233.257
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.57
LogP (Chemaxon):3.63

Name Annotations

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Descriptor Annotations

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