3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride
TL;DR: 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride (CAS 55748-82-8) is a chemical compound with molecular formula C14H23ClN2O2 and molecular weight 286.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-diethyl-5-(pyrrolidin-1-ylmethyl)-1H-pyridine-2,4-dione;hydrochloride
Also Known As: 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride, 2,4(1H,3H)-Pyridinedione, 3,3-diethyl-5-(1-pyrrolidinylmethyl)-, monohydrochloride, 3,3-diethyl-5-(pyrrolidin-1-ylmethyl)-1H-pyridine-2,4-dione hydrochloride, 3,3-Diethyl-5-[(pyrrolidin-1-yl)methyl]pyridine-2,4(1H,3H)-dione--hydrogen chloride (1/1), RefChem:245272
| Molecular Formula | C14H23ClN2O2 |
|---|---|
| Molecular Weight | 286.14 g/mol |
| LogP | 1.8932 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.1448 |
| Heavy Atoms | 19 |
| Complexity | 382.9072 |
Chemical Identifiers
| CAS Number | 55748-82-8 |
|---|---|
| SMILES | CCC1(C(=O)C(=CNC1=O)CN2CCCC2)CC.Cl |
Product Overview
3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride (CAS 55748-82-8), with molecular formula C14H23ClN2O2 and molecular weight 286.14 g/mol. IUPAC: 3,3-diethyl-5-(pyrrolidin-1-ylmethyl)-1H-pyridine-2,4-dione;hydrochloride.
Chemical Property Profile of 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride
Property Insights of 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride
The XLogP value of 1.8932 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride. With a topological polar surface area (TPSA) of 49.41 Ų, 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride has 1 hydrogen bond donor(s) and 3 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 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride?
The CAS number of 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride is 55748-82-8.
What is the molecular formula of 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride?
The molecular formula of 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride is C14H23ClN2O2.
What is the molecular weight of 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride?
The molecular weight of 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride is 286.14 g/mol.
Where can I buy 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride?
You can request a quote for 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Diethyl-5-pyrrolidinomethyl-2,4-pyridinedione hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.