≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | C1CCN(CC1)C(=O)C(CCNCC2=CC=C(C=C2)Cl)N.Cl.Cl |
|---|---|
| IUPAC Name | (2S)-2-amino-4-[(4-chlorophenyl)methylamino]-1-piperidin-1-ylbutan-1-one;dihydrochloride |
| InChIKey | IWXMOQGMIWZNPR-CKUXDGONSA-N |
| INCHI | 1S/C16H24ClN3O.2ClH/c17-14-6-4-13(5-7-14)12-19-9-8-15(18)16(21)20-10-2-1-3-11-20;;/h4-7,15,19H,1-3,8-12,18H2;2*1H/t15-;;/m0../s1 |
| Isomeric SMILES | C1CCN(CC1)C(=O)[C@H](CCNCC2=CC=C(C=C2)Cl)N.Cl.Cl |
| PubChem CID | 24757888 |
| Molecular Weight | 382.76 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic acids and derivatives |
| Class | Carboxylic acids and derivatives |
| Subclass | Amino acids, peptides, and analogues |
| Intermediate Tree Nodes | Amino acids and derivatives - Alpha amino acids and derivatives |
| Direct Parent | Alpha amino acid amides |
| Alternative Parents | N-acylpiperidines Phenylmethylamines Benzylamines Chlorobenzenes Aralkylamines Aryl chlorides Tertiary carboxylic acid amides Dialkylamines Azacyclic compounds Organochlorides Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Alpha-amino acid amide - N-acyl-piperidine - Benzylamine - Phenylmethylamine - Aralkylamine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Piperidine - Tertiary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Secondary aliphatic amine - Secondary amine - Primary amine - Primary aliphatic amine - Organic oxygen compound - Amine - Hydrochloride - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as alpha amino acid amides. These are amide derivatives of alpha amino acids. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 C2616181 | Certificate of Analysis | Mar 27, 2026 | U287973 |
| K2519160 | Certificate of Analysis | Dec 02, 2025 | U287973 |
| J2130475 | Certificate of Analysis | Aug 14, 2024 | U287973 |
| J2130476 | Certificate of Analysis | Aug 14, 2024 | U287973 |
| J2130477 | Certificate of Analysis | Aug 14, 2024 | U287973 |
| J2130478 | Certificate of Analysis | Aug 14, 2024 | U287973 |
| Solubility | Solvent:water, Max Conc. mg/mL: 38.28, Max Conc. mM: 100; Solvent:DMSO, Max Conc. mg/mL: 38.28, Max Conc. mM: 100 |
|---|---|
| Molecular Weight | 382.800 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 6 |
| Exact Mass | 381.114 Da |
| Monoisotopic Mass | 381.114 Da |
| Topological Polar Surface Area | 58.400 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 313.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 3 |
