2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate
TL;DR: 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate (CAS 796990-95-9) is a chemical compound with molecular formula C10H14N2O3 and molecular weight 210.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(ethylamino)-2-oxoethyl] 1-methylpyrrole-2-carboxylate
Also Known As: Ethylcarbamoylmethyl 1-methylpyrrole-2-carboxylate, 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate, (ethylcarbamoyl)methyl 1-methyl-1H-pyrrole-2-carboxylate, [2-(ethylamino)-2-oxoethyl] 1-methylpyrrole-2-carboxylate, 1H-Pyrrole-2-carboxylic acid, 1-methyl-, 2-(ethylamino)-2-oxoethyl ester (9CI)
| Molecular Formula | C10H14N2O3 |
|---|---|
| Molecular Weight | 210.10 g/mol |
| LogP | 0.318 |
| Topological Polar Surface Area | 60.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 210.10045 |
| Heavy Atoms | 15 |
| Complexity | 357.3044 |
Chemical Identifiers
| CAS Number | 796990-95-9 |
|---|---|
| SMILES | CCNC(=O)COC(=O)C1=CC=CN1C |
Product Overview
2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate (CAS 796990-95-9), with molecular formula C10H14N2O3 and molecular weight 210.10 g/mol. IUPAC: [2-(ethylamino)-2-oxoethyl] 1-methylpyrrole-2-carboxylate.
Chemical Property Profile of 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate
Property Insights of 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate
The XLogP value of 0.318 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate. The TPSA of 60.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate. Following Lipinski's Rule of Five, 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate has 1 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 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate?
The CAS number of 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate is 796990-95-9.
What is the molecular formula of 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate?
The molecular formula of 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate is C10H14N2O3.
What is the molecular weight of 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate?
The molecular weight of 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate is 210.10 g/mol.
Where can I buy 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate?
You can request a quote for 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(ethylamino)-2-oxoethyl 1-methyl-1H-pyrrole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.