Chemical ID: 4253393

c1ccc(cc1)C(CN)c2ccc(cc2)F
Chemical ID:
4253393
Name [?]:
2-(4-fluorophenyl)-2-phenyl-ethanamine
SMILES [?]:
c1ccc(cc1)C(CN)c2ccc(cc2)F
InChi [?]:
InChI=1/C14H14FN/c15-13-8-6-12(7-9-13)14(10-16)11-4-2-1-3-5-11/h1-9,14H,10,16H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,5,11,15,12,14,8,4,10,13,7,16,9/E:(2,3)(4,5)(6,7)(8,9)/rA:16cCCCCCCCCNCCCCCCF/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s7;s10;d11;s12;d13;d10s14;s13;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H14FN
All Atoms:16
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:7.4768
Area:389.524
Solvation:-2.26129
Coulombic:-18.9094
Bond Count [?]
All:17
Single:11
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:215.266
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:2.95
LogP (Chemaxon):3.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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