| CAS Number | 1909319-76-1 |
| Catalog Number | AG01C3QQ |
| Chemical Name | 1-{4-[(piperidin-4-yl)amino]piperidin-1-yl}ethan-1-one dihydrochloride |
| IUPAC Name | 1-[4-(piperidin-4-ylamino)piperidin-1-yl]ethanone;dihydrochloride |
| InChI | InChI=1S/C12H23N3O.2ClH/c1-10(16)15-8-4-12(5-9-15)14-11-2-6-13-7-3-11;;/h11-14H,2-9H2,1H3;2*1H |
| InChI Key | ULYHDQNVMFCVGP-UHFFFAOYSA-N |
| MDL Number | MFCD29762851 |
| Molecular Formula | C12H25Cl2N3O |
| Molecular Weight | 298.2524 |
| SMILES | Cl.Cl.CC(N1CCC(NC2CCNCC2)CC1)=O |
| Synonyms | 1-{4-[(piperidin-4-yl)amino]piperidin-1-yl}ethan-1-one dihydrochloride,
1909319-76-1,
Z2350941365,
|
| Complexity | 230 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 297.137g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 298.252g/mol |
| Monoisotopic Mass | 297.137g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 44.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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