Methyl 3-piperidin-1-ylpropanoate
TL;DR: Methyl 3-piperidin-1-ylpropanoate (CAS 946698-20-0) is a chemical compound with molecular formula C9H17NO2 and molecular weight 171.12593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-piperidin-1-ylpropanoate
Also Known As: methyl 3-piperidin-1-ylpropanoate, methyl 3-(piperidin-1-yl)propanoate, methyl 3-piperidylpropanoate, METHYL3- PROPANOATE, Methyl 3-(1-piperidinyl)propanoate
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H17NO2 |
| Molecular Weight | 171.12593 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 171.12593 Da |
| Heavy Atoms | 12 |
| Complexity | 141.0 |
| SMILES | COC(=O)CCN1CCCCC1 |
| InChIKey | ANAJGIRVGQSWEN-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 3-piperidin-1-ylpropanoate
Property Insights of Methyl 3-piperidin-1-ylpropanoate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-piperidin-1-ylpropanoate. With a topological polar surface area (TPSA) of 29.5 Ų, Methyl 3-piperidin-1-ylpropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-piperidin-1-ylpropanoate 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
What is the CAS number of Methyl 3-piperidin-1-ylpropanoate?
The CAS number of Methyl 3-piperidin-1-ylpropanoate is 946698-20-0.
What is the molecular formula of Methyl 3-piperidin-1-ylpropanoate?
The molecular formula of Methyl 3-piperidin-1-ylpropanoate is C9H17NO2.
What is the molecular weight of Methyl 3-piperidin-1-ylpropanoate?
The molecular weight of Methyl 3-piperidin-1-ylpropanoate is 171.12593 g/mol.
Where can I buy Methyl 3-piperidin-1-ylpropanoate?
You can request a quote for Methyl 3-piperidin-1-ylpropanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 3-piperidin-1-ylpropanoate?
Yes, CoreyChem provides custom synthesis services for Methyl 3-piperidin-1-ylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.