Chemical ID: 4663268

c1ccc(cc1)NCc2ccco2
Chemical ID:
4663268
Name [?]:
N-(2-furylmethyl)aniline
SMILES [?]:
c1ccc(cc1)NCc2ccco2
InChi [?]:
InChI=1/C11H11NO/c1-2-5-10(6-3-1)12-9-11-7-4-8-13-11/h1-8,12H,9H2
InChi Info:
AuxInfo=1/0/N:1,2,6,11,3,5,10,12,8,4,9,7,13/E:(2,3)(5,6)/rA:13nCCCCCCNCCCCCO/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s10;d11;s9s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H11NO
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.62828
Area:355.195
Solvation:-2.25159
Coulombic:-19.7317
Bond Count [?]
All:14
Single:9
Double:5
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:173.211
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.08
LogP (Chemaxon):2.35

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Descriptor Annotations

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