| CAS Number | 29368-92-1 |
| Catalog Number | AG002Y67(AGN-PC-00K25E) |
| Chemical Name | N-(2-(5-Methyl-1,2,4-oxadiazol-3-yl)phenyl)acetamide |
| IUPAC Name | N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide |
| InChI | InChI=1S/C11H11N3O2/c1-7(15)12-10-6-4-3-5-9(10)11-13-8(2)16-14-11/h3-6H,1-2H3,(H,12,15) |
| InChI Key | KIIQPHYXPNJOFZ-UHFFFAOYSA-N |
| MDL Number | MFCD01223978 |
| Molecular Formula | C11H11N3O2 |
| Molecular Weight | 217.2239 |
| SMILES | O1C(C)=NC(C2C(NC(C)=O)=CC=CC=2)=N1 |
| Synonyms | 29368-92-1,
N-(2-(5-Methyl-1,2,4-oxadiazol-3-yl)phenyl)acetamide,
N-[2-(5-Methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide,
Acetamide, N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-,
3-(2-Acetamidophenyl)-5-methyl-1,2,4-oxadiazole,
CTK0I4698,
DTXSID50512784,
ZINC76162797,
AKOS027440237,
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| Complexity | 260 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.228g/mol |
| Monoisotopic Mass | 217.085g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 68A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
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