| CAS Number | 31827-43-7 |
| Catalog Number | AG00I615(AGN-PC-0WR8SV) |
| Chemical Name | 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyridine |
| IUPAC Name | 5-cyclopropyl-3-pyridin-3-yl-1,2,4-oxadiazole |
| InChI | InChI=1S/C10H9N3O/c1-2-8(6-11-5-1)9-12-10(14-13-9)7-3-4-7/h1-2,5-7H,3-4H2 |
| InChI Key | PLPXFMBPDVRIJG-UHFFFAOYSA-N |
| MDL Number | MFCD00264581 |
| Molecular Formula | C10H9N3O |
| Molecular Weight | 187.1980 |
| SMILES | O1C(C2CC2)=NC(C2=CC=CN=C2)=N1 |
| Synonyms | 3-(5-Cyclopropyl-1,2,4-oxadiazol-3-yl)pyridine,
31827-43-7,
5-Cyclopropyl-3-(pyridin-3-yl)-1,2,4-oxadiazole,
MFCD00264581,
ZINC10536960,
F6617-2259,
3-(5-(Cyclopropyl-1,2,4-oxadiazol-3-yl)pyridine, AldrichCPR,
|
| Complexity | 208 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.202g/mol |
| Monoisotopic Mass | 187.075g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
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