3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester
TL;DR: 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester (CAS 3309-23-7) is a chemical compound with molecular formula C14H19NO2 and molecular weight 233.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 1-methylpiperidine-3-carboxylate
Also Known As: 1-Methylnipecotinic acid benzyl ester, 1-Methyl-nipecotinsaeurebenzylester, benzyl 1-methylpiperidine-3-carboxylate, Benzyl 1-methyl-3-piperidinecarboxylate, 1-Methyl-nipecotinsaeurebenzylester [German]
| Molecular Formula | C14H19NO2 |
|---|---|
| Molecular Weight | 233.14 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 233.14159 |
| Heavy Atoms | 17 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 3309-23-7 |
|---|---|
| SMILES | CN1CCCC(C1)C(=O)OCC2=CC=CC=C2 |
| InChIKey | GKNNRYJKHVPYCJ-UHFFFAOYSA-N |
Product Overview
3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester (CAS 3309-23-7), with molecular formula C14H19NO2 and molecular weight 233.14 g/mol. IUPAC: benzyl 1-methylpiperidine-3-carboxylate.
Chemical Property Profile of 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester
Property Insights of 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester. With a topological polar surface area (TPSA) of 29.5 Ų, 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester has 0 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-Piperidinecarboxylic acid, 1-methyl-, benzyl ester?
The CAS number of 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester is 3309-23-7.
What is the molecular formula of 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester?
The molecular formula of 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester is C14H19NO2.
What is the molecular weight of 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester?
The molecular weight of 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester is 233.14 g/mol.
Where can I buy 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester?
You can request a quote for 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-Piperidinecarboxylic acid, 1-methyl-, benzyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.