2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)-
TL;DR: 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)- (CAS 6229-94-3) is a chemical compound with molecular formula C16H23ClN2O and molecular weight 294.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,5R)-5-methyl-1-phenyl-3-piperidin-1-ylpyrrolidin-2-one;hydrochloride
Also Known As: 1,3,5,7-tetrazocane, KST-1A6864, (trans)-5-Methyl-1-phenyl-3-piperidino-2-pyrrolidinone hydrochloride, 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)-, (3r,5r)-5-methyl-1-phenyl-3-(piperidin-1-yl)pyrrolidin-2-one hydrochloride(1:1)
| Molecular Formula | C16H23ClN2O |
|---|---|
| Molecular Weight | 294.15 g/mol |
| LogP | 3.09 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.1499 |
| Heavy Atoms | 20 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 6229-94-3 |
|---|---|
| SMILES | C[C@@H]1C[C@H](C(=O)N1C2=CC=CC=C2)N3CCCCC3.Cl |
| InChIKey | NCPKFGJFXZBRFD-SWYZXDRTSA-N |
Product Overview
2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)- (CAS 6229-94-3), with molecular formula C16H23ClN2O and molecular weight 294.15 g/mol. IUPAC: (3R,5R)-5-methyl-1-phenyl-3-piperidin-1-ylpyrrolidin-2-one;hydrochloride.
Chemical Property Profile of 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)-
Property Insights of 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)-
The XLogP value of 3.09 indicates that 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)-?
The CAS number of 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)- is 6229-94-3.
What is the molecular formula of 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)-?
The molecular formula of 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)- is C16H23ClN2O.
What is the molecular weight of 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)-?
The molecular weight of 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)- is 294.15 g/mol.
Where can I buy 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)-?
You can request a quote for 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.