Chemical ID: 5832217

CC(C)c1ccc(cc1)CNCc2ccco2
Chemical ID:
5832217
Name [?]:
N-(2-furylmethyl)-1-(4-isopropylphenyl)-methanamine
SMILES [?]:
CC(C)c1ccc(cc1)CNCc2ccco2
InChi [?]:
InChI=1/C15H19NO/c1-12(2)14-7-5-13(6-8-14)10-16-11-15-4-3-9-17-15/h3-9,12,16H,10-11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,15,14,6,8,5,9,16,10,12,2,7,4,13,11,17/E:(1,2)(5,6)(7,8)/rA:17nCCCCCCCCCCNCCCCCO/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;s10;s11;s12;d13;s14;d15;s13s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H19NO
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.83158
Area:449.109
Solvation:-2.39615
Coulombic:-17.5028
Bond Count [?]
All:18
Single:13
Double:5
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:229.318
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.35
LogP (Chemaxon):3.49

Name Annotations

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Descriptor Annotations

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