Chemical ID: 5829804

CCN(CC)Cc1ccccc1OCC
Chemical ID:
5829804
Name [?]:
N-[(2-ethoxyphenyl)methyl]-N-ethyl-ethanamine
SMILES [?]:
CCN(CC)Cc1ccccc1OCC
InChi [?]:
InChI=1/C13H21NO/c1-4-14(5-2)11-12-9-7-8-10-13(12)15-6-3/h7-10H,4-6,11H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,5,15,2,4,14,9,10,8,11,6,7,12,3,13/E:(1,2)(4,5)/rA:15nCCNCCCCCCCCCOCC/rB:s1;s2;s3;s4;s3;s6;s7;d8;s9;d10;d7s11;s12;s13;s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H21NO
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.51623
Area:402.255
Solvation:-2.54015
Coulombic:-13.3044
Bond Count [?]
All:15
Single:12
Double:3
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:207.312
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.96
LogP (Chemaxon):2.71

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Descriptor Annotations

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