| CAS Number | 1609403-11-3 |
| Catalog Number | AG00J27E(AGN-PC-0WP0QV) |
| Chemical Name | 4-[(5-Methyl-1,2,4-oxadiazol-3-YL)methyl]piperidine hydrochloride |
| IUPAC Name | 5-methyl-3-(piperidin-4-ylmethyl)-1,2,4-oxadiazole;hydrochloride |
| InChI | InChI=1S/C9H15N3O.ClH/c1-7-11-9(12-13-7)6-8-2-4-10-5-3-8;/h8,10H,2-6H2,1H3;1H |
| InChI Key | DTOLPJCFHFDCQH-UHFFFAOYSA-N |
| MDL Number | MFCD26959396 |
| Molecular Formula | C9H16ClN3O |
| Molecular Weight | 217.6958 |
| SMILES | Cl.CC1ON=C(CC2CCNCC2)N=1 |
| Synonyms | 1609403-11-3,
5-methyl-3-(piperidin-4-ylmethyl)-1,2,4-oxadiazole hydrochloride,
4-[(5-METHYL-1,2,4-OXADIAZOL-3-YL)METHYL]PIPERIDINE HYDROCHLORIDE,
DTOLPJCFHFDCQH-UHFFFAOYSA-N,
SCHEMBL16400653,
MFCD26959396,
4-(2-FUROYLAMINO)-3-METHYLBENZOIC ACID,
|
| Complexity | 159 |
| 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 | 0 |
| Undefined Bond Stereocenter Count | 0 |
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