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Chemical ID: 6618766
Chemical ID:
6618766
Name [?]:
N-(4-amino-2-methoxy-phenyl)-2-phenoxy-acetamide
SMILES [?]:
COc1cc(ccc1NC(=O)COc2ccccc2)N
InChi [?]:
InChI=1/C15H16N2O3/c1-19-14-9-11(16)7-8-13(14)17-15(18)10-20-12-5-3-2-4-6-12/h2-9H,10,16H2,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,17,16,18,15,19,6,7,4,12,5,14,8,3,10,20,9,11,2,13/E:(3,4)(5,6)/rA:20nCOCCCCCCNCOCOCCCCCCN/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s5;/rC:;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H16N2O3 |
All Atoms: | 20 |
Heavy Atoms: | 20 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.9709 |
Area: | 475.749 |
Solvation: | -4.92282 |
Coulombic: | -52.4526 |
Bond Count [?]
All: | 21 |
Single: | 14 |
Double: | 7 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 272.299 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 5 |
XLogP: | 1.35 |
LogP (Chemaxon): | 1.84 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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