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Chemical ID: 6474355
Chemical ID:
6474355
Name [?]:
2-(4-methylphenoxy)-N-[4-(morpholinomethyl)phenyl]-acetamide
SMILES [?]:
Cc1ccc(cc1)OCC(=O)Nc2ccc(cc2)CN3CCOCC3
InChi [?]:
InChI=1/C20H24N2O3/c1-16-2-8-19(9-3-16)25-15-20(23)21-18-6-4-17(5-7-18)14-22-10-12-24-13-11-22/h2-9H,10-15H2,1H3,(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,3,7,15,17,14,18,4,6,21,25,22,24,19,9,2,16,13,5,10,12,20,11,23,8/E:(2,3)(4,5)(6,7)(8,9)(10,11)(12,13)/rA:25nCCCCCCCOCCONCCCCCCCNCCOCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;s16;s19;s20;s21;s22;s23;s20s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C20H24N2O3 |
All Atoms: | 25 |
Heavy Atoms: | 25 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.48837 |
Area: | 574.323 |
Solvation: | -5.8697 |
Coulombic: | -41.4124 |
Bond Count [?]
All: | 27 |
Single: | 20 |
Double: | 7 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 340.416 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 5 |
XLogP: | 2.46 |
LogP (Chemaxon): | 2.89 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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