Chemical ID: 7101837

CCCNCc1cccc(c1)OCc2ccc(cc2)F
Chemical ID:
7101837
Name [?]:
N-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]propan-1-amine
SMILES [?]:
CCCNCc1cccc(c1)OCc2ccc(cc2)F
InChi [?]:
InChI=1/C17H20FNO/c1-2-10-19-12-15-4-3-5-17(11-15)20-13-14-6-8-16(18)9-7-14/h3-9,11,19H,2,10,12-13H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,8,7,9,15,19,16,18,3,11,5,13,14,6,17,10,20,4,12/E:(6,7)(8,9)/rA:20nCCCNCCCCCCCOCCCCCCCF/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s10;s12;s13;s14;d15;s16;d17;d14s18;s17;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H20FNO
All Atoms:40
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.01142
Area:500.529
Solvation:-3.50181
Coulombic:-22.5177
Bond Count [?]
All:21
Single:15
Double:6
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:273.345
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.1
LogP (Chemaxon):4.05

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Descriptor Annotations

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