| CAS Number | 65921-40-6 |
| Catalog Number | AG006MHU(AGN-PC-0OFHTX) |
| Chemical Name | 1-L-prolylpiperidine |
| IUPAC Name | piperidin-1-yl-[(2S)-pyrrolidin-2-yl]methanone |
| InChI | InChI=1S/C10H18N2O/c13-10(9-5-4-6-11-9)12-7-2-1-3-8-12/h9,11H,1-8H2/t9-/m0/s1 |
| InChI Key | VTWSMIPLWRXVEQ-VIFPVBQESA-N |
| MDL Number | MFCD09725367 |
| Molecular Formula | C10H18N2O |
| Molecular Weight | 182.2627 |
| SMILES | C(=O)([C@@H]1CCCN1)N1CCCCC1 |
| Synonyms | 1-L-prolylpiperidine,
65921-40-6,
Piperidine, 1-[(2S)-2-pyrrolidinylcarbonyl]-,
SCHEMBL3335449,
CTK1J5555,
DTXSID10472113,
MFCD09725367,
ZINC11754369,
AKOS010391826,
AJ-60017,
Y-5361,
(Piperidin-1-yl)[(2S)-pyrrolidin-2-yl]methanone,
CID11769183,
(S)-piperidin-1-yl(pyrrolidin-2-yl)methanone,
Piperidine,1-[ -2-pyrrolidinylcarbonyl]-,
1-piperidyl-[(2S)-pyrrolidin-2-yl]methanone,
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| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 182.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 182.267g/mol |
| Monoisotopic Mass | 182.142g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number