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Chemical ID: 7282640
Chemical ID:
7282640
Name [?]:
2-(4-acetylphenoxy)-N-(m-tolyl)acetamide
SMILES [?]:
Cc1cccc(c1)NC(=O)COc2ccc(cc2)C(=O)C
InChi [?]:
InChI=1/C17H17NO3/c1-12-4-3-5-15(10-12)18-17(20)11-21-16-8-6-14(7-9-16)13(2)19/h3-10H,11H2,1-2H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,21,4,3,5,15,17,14,18,7,11,2,19,16,6,13,9,8,20,10,12/E:(6,7)(8,9)/rA:21nCCCCCCCNCOCOCCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s11;s12;s13;d14;s15;d16;d13s17;s16;d19;s19;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C17H17NO3 |
All Atoms: | 38 |
Heavy Atoms: | 21 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.4358 |
Area: | 501.681 |
Solvation: | -5.10622 |
Coulombic: | -35.5215 |
Bond Count [?]
All: | 22 |
Single: | 14 |
Double: | 8 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 283.322 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 4 |
XLogP: | 2.95 |
LogP (Chemaxon): | 2.65 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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