| CAS Number | 1172699-87-4 |
| Catalog Number | AG019VA5(AGN-PC-06D7P1) |
| Chemical Name | N-{2-[bis(propan-2-yl)amino]ethyl}piperidine-4-carboxamide dihydrochloride |
| IUPAC Name | N-[2-[di(propan-2-yl)amino]ethyl]piperidine-4-carboxamide;dihydrochloride |
| InChI | InChI=1S/C14H29N3O.2ClH/c1-11(2)17(12(3)4)10-9-16-14(18)13-5-7-15-8-6-13;;/h11-13,15H,5-10H2,1-4H3,(H,16,18);2*1H |
| InChI Key | IOUWAKSVPRRNTA-UHFFFAOYSA-N |
| MDL Number | MFCD00184090 |
| Molecular Formula | C14H31Cl2N3O |
| Molecular Weight | 328.3214 |
| SMILES | Cl.Cl.CC(N(C(C)C)CCNC(C1CCNCC1)=O)C |
| Synonyms | N-{2-[bis(propan-2-yl)amino]ethyl}piperidine-4-carboxamide dihydrochloride,
1172699-87-4,
AC1Q3A5L,
CTK6A9304,
AKOS008090911,
MCULE-9527280135,
NE29090,
EN300-44205,
J-003546,
|
| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 327.184g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 328.322g/mol |
| Monoisotopic Mass | 327.184g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 44.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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