Nicotinic acid, 3-(2'-methylpiperidino)propyl ester
TL;DR: Nicotinic acid, 3-(2'-methylpiperidino)propyl ester (CAS 64038-02-4) is a chemical compound with molecular formula C15H22N2O2 and molecular weight 262.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylpiperidin-1-yl)propyl pyridine-3-carboxylate
Also Known As: 3-(2-methylpiperidin-1-yl)propyl pyridine-3-carboxylate, 3-(2-Methylpiperidino)propyl=nicotinate, NICOTINIC ACID, 3-(2'-METHYLPIPERIDINO)PROPYL ESTER, Pyridine-3-carboxylic acid, 3'-(2''-methylpiperidino)propyl ester, 1-Naphthylamine,N-methyl-1,2,3,4-tetrahydro-,hydrochloride
| Molecular Formula | C15H22N2O2 |
|---|---|
| Molecular Weight | 262.17 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 262.16812 |
| Heavy Atoms | 19 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 64038-02-4 |
|---|---|
| SMILES | CC1CCCCN1CCCOC(=O)C2=CN=CC=C2 |
| InChIKey | UYOCGYKHIPHFBD-UHFFFAOYSA-N |
Product Overview
Nicotinic acid, 3-(2'-methylpiperidino)propyl ester (CAS 64038-02-4), with molecular formula C15H22N2O2 and molecular weight 262.17 g/mol. IUPAC: 3-(2-methylpiperidin-1-yl)propyl pyridine-3-carboxylate.
Chemical Property Profile of Nicotinic acid, 3-(2'-methylpiperidino)propyl ester
Property Insights of Nicotinic acid, 3-(2'-methylpiperidino)propyl ester
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nicotinic acid, 3-(2'-methylpiperidino)propyl ester. With a topological polar surface area (TPSA) of 42.4 Ų, Nicotinic acid, 3-(2'-methylpiperidino)propyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nicotinic acid, 3-(2'-methylpiperidino)propyl ester has 0 hydrogen bond donor(s) and 4 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 Nicotinic acid, 3-(2'-methylpiperidino)propyl ester?
The CAS number of Nicotinic acid, 3-(2'-methylpiperidino)propyl ester is 64038-02-4.
What is the molecular formula of Nicotinic acid, 3-(2'-methylpiperidino)propyl ester?
The molecular formula of Nicotinic acid, 3-(2'-methylpiperidino)propyl ester is C15H22N2O2.
What is the molecular weight of Nicotinic acid, 3-(2'-methylpiperidino)propyl ester?
The molecular weight of Nicotinic acid, 3-(2'-methylpiperidino)propyl ester is 262.17 g/mol.
Where can I buy Nicotinic acid, 3-(2'-methylpiperidino)propyl ester?
You can request a quote for Nicotinic acid, 3-(2'-methylpiperidino)propyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nicotinic acid, 3-(2'-methylpiperidino)propyl ester?
Yes, KEHONG BIO provides custom synthesis services for Nicotinic acid, 3-(2'-methylpiperidino)propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.