5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid
TL;DR: 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid (CAS 6322-24-3) is a chemical compound with molecular formula C10H17NO2 and molecular weight 183.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-butyl-2,3,4,5-tetrahydropyridine-6-carboxylic acid
Also Known As: 5-butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid, 3-butyl-2,3,4,5-tetrahydropyridine-6-carboxylic acid
| Molecular Formula | C10H17NO2 |
|---|---|
| Molecular Weight | 183.13 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 183.12593 |
| Heavy Atoms | 13 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 6322-24-3 |
|---|---|
| SMILES | CCCCC1CCC(=NC1)C(=O)O |
| InChIKey | VNAADMGMKMLUDU-UHFFFAOYSA-N |
Product Overview
5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid (CAS 6322-24-3), with molecular formula C10H17NO2 and molecular weight 183.13 g/mol. IUPAC: 3-butyl-2,3,4,5-tetrahydropyridine-6-carboxylic acid.
Chemical Property Profile of 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid
Property Insights of 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid. With a topological polar surface area (TPSA) of 49.7 Ų, 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid 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 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid?
The CAS number of 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid is 6322-24-3.
What is the molecular formula of 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid?
The molecular formula of 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid is C10H17NO2.
What is the molecular weight of 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid?
The molecular weight of 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid is 183.13 g/mol.
Where can I buy 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid?
You can request a quote for 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Butyl-3,4,5,6-tetrahydropyridine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.