3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine
TL;DR: 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine (CAS 34848-29-8) is a chemical compound with molecular formula C10H14N2O and molecular weight 178.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine
Also Known As: (+)-Nicotine 1'-oxide, 2'betaH-Nicotine, 1'-oxide, 1-hydroxy-1-methyl-5-(pyridin-3-yl)pyrrolidin-1-ium-2-ide, 3-(1-hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine, 3-(1-hydroxy-1-methyl-3,4-dihydro-2H-pyrrol-2-yl)pyridine
| Molecular Formula | C10H14N2O |
|---|---|
| Molecular Weight | 178.11 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 33.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 178.11061 |
| Heavy Atoms | 13 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 34848-29-8 |
|---|---|
| SMILES | C[N+]1([CH-]CCC1C2=CN=CC=C2)O |
| InChIKey | BASXBFGOKNFJAM-UHFFFAOYSA-N |
Product Overview
3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine (CAS 34848-29-8), with molecular formula C10H14N2O and molecular weight 178.11 g/mol. IUPAC: 3-(1-hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine.
Chemical Property Profile of 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine
Property Insights of 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine. With a topological polar surface area (TPSA) of 33.1 Ų, 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine 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-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine?
The CAS number of 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine is 34848-29-8.
What is the molecular formula of 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine?
The molecular formula of 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine is C10H14N2O.
What is the molecular weight of 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine?
The molecular weight of 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine is 178.11 g/mol.
Where can I buy 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine?
You can request a quote for 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-Hydroxy-1-methylpyrrolidin-1-ium-5-id-2-yl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.