Chemical ID: 4122055

Cc1cccc(c1)CNCc2ccco2
Chemical ID:
4122055
Name [?]:
N-(2-furylmethyl)-1-(m-tolyl)methanamine
SMILES [?]:
Cc1cccc(c1)CNCc2ccco2
InChi [?]:
InChI=1/C13H15NO/c1-11-4-2-5-12(8-11)9-14-10-13-6-3-7-15-13/h2-8,14H,9-10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,4,13,3,5,12,14,7,8,10,2,6,11,9,15/rA:15nCCCCCCCCNCCCCCO/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;s10;d11;s12;d13;s11s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H15NO
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.69137
Area:404.158
Solvation:-2.41257
Coulombic:-16.8622
Bond Count [?]
All:16
Single:11
Double:5
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:201.264
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.38
LogP (Chemaxon):2.76

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Descriptor Annotations

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