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Chemical ID: 4187266
Chemical ID:
4187266
Name [?]:
2-(2-methoxyphenoxy)-N-(2-pyridylmethyl)acetamide
SMILES [?]:
COc1ccccc1OCC(=O)NCc2ccccn2
InChi [?]:
InChI=1/C15H16N2O3/c1-19-13-7-2-3-8-14(13)20-11-15(18)17-10-12-6-4-5-9-16-12/h2-9H,10-11H2,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,5,6,17,18,16,4,7,19,14,10,15,3,8,11,20,13,12,2,9/rA:20nCOCCCCCCOCCONCCCCCCN/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;s10;d11;s11;s13;s14;s15;d16;s17;d18;d15s19;/rC:;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H16N2O3 |
All Atoms: | 20 |
Heavy Atoms: | 20 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 5.50079 |
Area: | 490.654 |
Solvation: | -6.76555 |
Coulombic: | -39.8768 |
Bond Count [?]
All: | 21 |
Single: | 14 |
Double: | 7 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 272.299 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 4 |
XLogP: | 1.3 |
LogP (Chemaxon): | 1.08 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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