Ethyl 4-methylpiperidine-1-carboxylate
TL;DR: Ethyl 4-methylpiperidine-1-carboxylate (CAS 91874-97-4) is a chemical compound with molecular formula C9H17NO2 and molecular weight 171.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-methylpiperidine-1-carboxylate
Also Known As: ethyl 4-methylpiperidine-1-carboxylate, NCIOpen2_000387, 4-Methyl-piperidin-carbonsaeure-(1)-ethylester, 1-Piperidinecarboxylic acid, 4-methyl-, ethyl ester
| Molecular Formula | C9H17NO2 |
|---|---|
| Molecular Weight | 171.13 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 171.12593 |
| Heavy Atoms | 12 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 91874-97-4 |
|---|---|
| SMILES | CCOC(=O)N1CCC(CC1)C |
| InChIKey | AILZEXMVCHHZDU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 4-methylpiperidine-1-carboxylate (CAS 91874-97-4), with molecular formula C9H17NO2 and molecular weight 171.13 g/mol. IUPAC: ethyl 4-methylpiperidine-1-carboxylate.
Chemical Property Profile of Ethyl 4-methylpiperidine-1-carboxylate
Property Insights of Ethyl 4-methylpiperidine-1-carboxylate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-methylpiperidine-1-carboxylate. With a topological polar surface area (TPSA) of 29.5 Ų, Ethyl 4-methylpiperidine-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-methylpiperidine-1-carboxylate has 0 hydrogen bond donor(s) and 2 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 Ethyl 4-methylpiperidine-1-carboxylate?
The CAS number of Ethyl 4-methylpiperidine-1-carboxylate is 91874-97-4.
What is the molecular formula of Ethyl 4-methylpiperidine-1-carboxylate?
The molecular formula of Ethyl 4-methylpiperidine-1-carboxylate is C9H17NO2.
What is the molecular weight of Ethyl 4-methylpiperidine-1-carboxylate?
The molecular weight of Ethyl 4-methylpiperidine-1-carboxylate is 171.13 g/mol.
Where can I buy Ethyl 4-methylpiperidine-1-carboxylate?
You can request a quote for Ethyl 4-methylpiperidine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-methylpiperidine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-methylpiperidine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.