| CAS Number | 1375474-26-2 |
| Catalog Number | AG019TIF(AGN-PC-0WOSLS) |
| Chemical Name | 3-(5-Cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine hydrochloride |
| IUPAC Name | 5-cyclopropyl-3-piperidin-3-yl-1,2,4-oxadiazole;hydrochloride |
| InChI | InChI=1S/C10H15N3O.ClH/c1-2-8(6-11-5-1)9-12-10(14-13-9)7-3-4-7;/h7-8,11H,1-6H2;1H |
| InChI Key | XQXQKRMSRZJIKC-UHFFFAOYSA-N |
| MDL Number | MFCD21602641 |
| Molecular Formula | C10H16ClN3O |
| Molecular Weight | 229.7065 |
| SMILES | Cl.C1C(C2ON=C(C3CNCCC3)N=2)C1 |
| Synonyms | 3-(5-Cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine hydrochloride,
1375474-26-2,
5-Cyclopropyl-3-(piperidin-3-yl)-1,2,4-oxadiazole hydrochloride,
AKOS025442215,
KS-7575,
MCULE-1490307853,
NE30960,
Z1318356920,
|
| Complexity | 208 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.708g/mol |
| Monoisotopic Mass | 229.098g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 51A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number