Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate
TL;DR: Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate (CAS 307341-05-5) is a chemical compound with molecular formula C16H24N2O3 and molecular weight 292.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2,4-dimethyl-5-(2-piperidin-1-ylacetyl)-1H-pyrrole-3-carboxylate
Also Known As: AE-848/12560205, ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate, ethyl 2,4-dimethyl-5-(1-piperidinylacetyl)-1H-pyrrole-3-carboxylate, ethyl 2,4-dimethyl-5-(2-piperidin-1-ylacetyl)-1H-pyrrole-3-carboxylate, Ethyl 2,4-dimethyl-5-[2-(1-piperidyl)acetyl]-1H-pyrrole-3-carboxylate
| Molecular Formula | C16H24N2O3 |
|---|---|
| Molecular Weight | 292.18 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 62.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 292.17868 |
| Heavy Atoms | 21 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 307341-05-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C1C)C(=O)CN2CCCCC2)C |
| InChIKey | FZOOWEUECAVFLQ-UHFFFAOYSA-N |
Product Overview
Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate (CAS 307341-05-5), with molecular formula C16H24N2O3 and molecular weight 292.18 g/mol. IUPAC: ethyl 2,4-dimethyl-5-(2-piperidin-1-ylacetyl)-1H-pyrrole-3-carboxylate.
Chemical Property Profile of Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate
Property Insights of Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate. The TPSA of 62.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate has 1 hydrogen bond donor(s) and 4 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 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate?
The CAS number of Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate is 307341-05-5.
What is the molecular formula of Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate?
The molecular formula of Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate is C16H24N2O3.
What is the molecular weight of Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate?
The molecular weight of Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate is 292.18 g/mol.
Where can I buy Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate?
You can request a quote for Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2,4-dimethyl-5-(2-piperidylacetyl)pyrrole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.