| CAS Number | 111247-63-3 |
| Catalog Number | AG019SWC(AGN-PC-0P1SW2) |
| Chemical Name | 1-(Piperidin-4-ylmethyl)pyrrolidin-2-one hydrochloride |
| IUPAC Name | 1-(piperidin-4-ylmethyl)pyrrolidin-2-one;hydrochloride |
| InChI | InChI=1S/C10H18N2O.ClH/c13-10-2-1-7-12(10)8-9-3-5-11-6-4-9;/h9,11H,1-8H2;1H |
| InChI Key | NMKHSQHHAFEVRR-UHFFFAOYSA-N |
| MDL Number | MFCD20731152 |
| Molecular Formula | C10H19ClN2O |
| Molecular Weight | 218.7237 |
| SMILES | Cl.O=C1N(CC2CCNCC2)CCC1 |
| Synonyms | 1-(piperidin-4-ylmethyl)pyrrolidin-2-one hydrochloride,
111247-63-3,
SCHEMBL190200,
NMKHSQHHAFEVRR-UHFFFAOYSA-N,
AKOS026742413,
1-(4-Piperidinylmethyl)-2-pyrrolidinone HCl,
1-piperidin-4-ylmethyl-pyrrolidin-2-one hydrochloride salt,
139726-90-2,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.119g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.725g/mol |
| Monoisotopic Mass | 218.119g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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