1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid
TL;DR: 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid (CAS 1025088-78-1) is a chemical compound with molecular formula C14H17NO4 and molecular weight 263.11575 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(1,3-benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid
Also Known As: 1-(1,3-benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid, 1-(1,3-benzodioxol-5-ylmethyl)-2-piperidinecarboxylic acid, 1-(benzo[1,3]dioxol-5-ylmethyl)piperidine-2-carboxylic Acid, 1-[(2H-1,3-Benzodioxol-5-yl)methyl]piperidine-2-carboxylic acid, 1-Benzo[1,3]dioxol-5-ylmethyl-piperidine-2-carboxylic acid 1HCl salt
Technical Specifications
| Molecular Formula | C14H17NO4 |
| Molecular Weight | 263.11575 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.11575 Da |
| Heavy Atoms | 19 |
| Complexity | 335.0 |
| SMILES | C1CCN(C(C1)C(=O)O)CC2=CC3=C(C=C2)OCO3 |
| InChIKey | YYKYJJKTXQOKDU-UHFFFAOYSA-N |
Chemical Property Profile of 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid
Property Insights of 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid
The XLogP value of -0.2 indicates that 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 59.0 Ų, 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid?
The CAS number of 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid is 1025088-78-1.
What is the molecular formula of 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid?
The molecular formula of 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid is C14H17NO4.
What is the molecular weight of 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid?
The molecular weight of 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid is 263.11575 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid?
You can request a quote for 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 1-(1,3-Benzodioxol-5-ylmethyl)piperidine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.