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Chemical ID: 7276523
Chemical ID:
7276523
Name [?]:
N-(3,4-dimethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)-acetamide
SMILES [?]:
CC1CN(CC(O1)C)CC(=O)Nc2ccc(c(c2)OC)OC
InChi [?]:
InChI=1/C16H24N2O4/c1-11-8-18(9-12(2)22-11)10-16(19)17-13-5-6-14(20-3)15(7-13)21-4/h5-7,11-12H,8-10H2,1-4H3,(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,8,22,20,14,15,18,3,5,9,2,6,13,16,17,10,12,4,11,21,19,7/E:(1,2)(8,9)(11,12)/rA:22cCCCNCCOCCCONCCCCCCOCOC/rB:s1;s2;s3;s4;s5;s2s6;s6;s4;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;s17;s19;s16;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H24N2O4 |
All Atoms: | 46 |
Heavy Atoms: | 22 |
Chiral Atoms: | 2 |
ZAP Information [?]
Total: | 5.59392 |
Area: | 520.269 |
Solvation: | -7.4128 |
Coulombic: | -45.9016 |
Bond Count [?]
All: | 23 |
Single: | 19 |
Double: | 4 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 308.373 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 6 |
XLogP: | 0.88 |
LogP (Chemaxon): | 1.22 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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