Chemical ID: 6146655

Cc1ccc(c(c1C)OCC(=O)NC(C)(C)C)C
Chemical ID:
6146655
Name [?]:
N-tert-butyl-2-(2,3,6-trimethylphenoxy)-acetamide
SMILES [?]:
Cc1ccc(c(c1C)OCC(=O)NC(C)(C)C)C
InChi [?]:
InChI=1/C15H23NO2/c1-10-7-8-11(2)14(12(10)3)18-9-13(17)16-15(4,5)6/h7-8H,9H2,1-6H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,18,8,15,16,17,3,4,10,2,5,7,11,6,14,13,12,9/E:(4,5,6)/rA:18nCCCCCCCCOCCONCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s9;s10;d11;s11;s13;s14;s14;s14;s5;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H23NO2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.2388
Area:455.678
Solvation:-3.15316
Coulombic:-29.3099
Bond Count [?]
All:18
Single:14
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:249.349
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.3
LogP (Chemaxon):2.95

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Descriptor Annotations

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