Chemical ID: 7105156

c1ccc(c(c1)CNCCc2ccc(cc2)F)F
Chemical ID:
7105156
Name [?]:
2-(4-fluorophenyl)-N-[(2-fluorophenyl)methyl]ethanamine
SMILES [?]:
c1ccc(c(c1)CNCCc2ccc(cc2)F)F
InChi [?]:
InChI=1/C15H15F2N/c16-14-7-5-12(6-8-14)9-10-18-11-13-3-1-2-4-15(13)17/h1-8,18H,9-11H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,12,16,13,15,10,9,7,11,5,14,4,17,18,8/E:(5,6)(7,8)/rA:18nCCCCCCCNCCCCCCCCFF/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;s9;s10;s11;d12;s13;d14;d11s15;s14;s4;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H15F2N
All Atoms:33
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.20479
Area:441.467
Solvation:-2.83189
Coulombic:-19.2045
Bond Count [?]
All:19
Single:13
Double:6
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:247.283
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.72
LogP (Chemaxon):3.88

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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