Chemical ID: 7106213

c1ccc(c(c1)COc2cccc(c2)CNC3CC3)F
Chemical ID:
7106213
Name [?]:
N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]cyclopropanamine
SMILES [?]:
c1ccc(c(c1)COc2cccc(c2)CNC3CC3)F
InChi [?]:
InChI=1/C17H18FNO/c18-17-7-2-1-5-14(17)12-20-16-6-3-4-13(10-16)11-19-15-8-9-15/h1-7,10,15,19H,8-9,11-12H2
InChi Info:
AuxInfo=1/0/N:1,2,11,12,6,10,3,18,19,14,15,7,13,5,17,9,4,20,16,8/E:(8,9)/rA:20nCCCCCCCOCCCCCCCNCCCF/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;s9;d10;s11;d12;d9s13;s13;s15;s16;s17;s17s18;s4;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18FNO
All Atoms:38
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.44077
Area:488.603
Solvation:-2.7743
Coulombic:-22.9245
Bond Count [?]
All:22
Single:16
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:271.329
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.86
LogP (Chemaxon):3.63

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Descriptor Annotations

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