Chemical ID: 7108625

c1cc(ccc1CNC2CCCCCCC2)F
Chemical ID:
7108625
Name [?]:
N-[(4-fluorophenyl)methyl]cyclooctanamine
SMILES [?]:
c1cc(ccc1CNC2CCCCCCC2)F
InChi [?]:
InChI=1/C15H22FN/c16-14-10-8-13(9-11-14)12-17-15-6-4-2-1-3-5-7-15/h8-11,15,17H,1-7,12H2
InChi Info:
AuxInfo=1/0/N:13,12,14,11,15,10,16,1,5,2,4,7,6,3,9,17,8/E:(2,3)(4,5)(6,7)(8,9)(10,11)/rA:17nCCCCCCCNCCCCCCCCF/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;s9;s10;s11;s12;s13;s14;s9s15;s3;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H22FN
All Atoms:39
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.72442
Area:420.659
Solvation:-1.79206
Coulombic:-15.234
Bond Count [?]
All:18
Single:15
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:235.34
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.66
LogP (Chemaxon):4.09

Name Annotations

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Descriptor Annotations

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