Chemical ID: 5188466

CCc1cccc(c1N(C(=O)C)C(=O)C)CC
Chemical ID:
5188466
Name [?]:
N-acetyl-N-(2,6-diethylphenyl)-acetamide
SMILES [?]:
CCc1cccc(c1N(C(=O)C)C(=O)C)CC
InChi [?]:
InChI=1/C14H19NO2/c1-5-12-8-7-9-13(6-2)14(12)15(10(3)16)11(4)17/h7-9H,5-6H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,17,12,15,2,16,5,4,6,10,13,3,7,8,9,11,14/E:(1,2)(3,4)(5,6)(8,9)(10,11)(12,13)(16,17)/rA:17nCCCCCCCCNCOCCOCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s9;d13;s13;s7;s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H19NO2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:6.58296
Area:393.353
Solvation:-3.25087
Coulombic:-22.9718
Bond Count [?]
All:17
Single:12
Double:5
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:233.306
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.25
LogP (Chemaxon):2.62

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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