| CAS Number | 2138157-75-0 |
| Catalog Number | AG01EJ4K |
| Chemical Name | 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperidine hydrochloride |
| IUPAC Name | 3-methyl-5-(piperidin-3-ylmethyl)-1,2,4-oxadiazole;hydrochloride |
| InChI | InChI=1S/C9H15N3O.ClH/c1-7-11-9(13-12-7)5-8-3-2-4-10-6-8;/h8,10H,2-6H2,1H3;1H |
| InChI Key | XGSPFWCZNJHNTH-UHFFFAOYSA-N |
| MDL Number | MFCD31439549 |
| Molecular Formula | C9H16ClN3O |
| Molecular Weight | 217.6958 |
| SMILES | Cl.CC1N=C(CC2CNCCC2)ON=1 |
| Synonyms | 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperidine hydrochloride,
2138157-75-0,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.697g/mol |
| Monoisotopic Mass | 217.098g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 51A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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