Chemical ID: 4236993

Cc1cc(c(c(c1)C)OCCN(C)C)C
Chemical ID:
4236993
Name [?]:
N,N-dimethyl-2-(2,4,6-trimethylphenoxy)-ethanamine
SMILES [?]:
Cc1cc(c(c(c1)C)OCCN(C)C)C
InChi [?]:
InChI=1/C13H21NO/c1-10-8-11(2)13(12(3)9-10)15-7-6-14(4)5/h8-9H,6-7H2,1-5H3
InChi Info:
AuxInfo=1/0/N:1,8,15,13,14,11,10,7,3,2,6,4,5,12,9/E:(2,3)(4,5)(8,9)(11,12)/rA:15nCCCCCCCCOCCNCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;s9;s10;s11;s12;s12;s4;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H21NO
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.46454
Area:399.253
Solvation:-2.51679
Coulombic:-12.9021
Bond Count [?]
All:15
Single:12
Double:3
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:207.312
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.68
LogP (Chemaxon):3.17

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Descriptor Annotations

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