3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride
TL;DR: 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride (CAS 23853-82-9) is a chemical compound with molecular formula C21H28ClN3O4 and molecular weight 421.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(N-methylanilino)-N-(3,4,5-trimethoxyphenyl)pyrrolidine-1-carboxamide;hydrochloride
Also Known As: 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride, 1-Pyrrolidinecarboxanilide, 3-(N-methylanilino)-3',4',5'-trimethoxy-, monohydrochloride, 3-[methyl(phenyl)amino]-n-(3,4,5-trimethoxyphenyl)pyrrolidine-1-carboxamide hydrochloride(1:1), 3-(N-methylanilino)-N-(3,4,5-trimethoxyphenyl)pyrrolidine-1-carboxamide hydrochloride, 3-[Methyl(phenyl)amino]-N-(3,4,5-trimethoxyphenyl)pyrrolidine-1-carboximidic acid--hydrogen chloride (1/1)
| Molecular Formula | C21H28ClN3O4 |
|---|---|
| Molecular Weight | 421.18 g/mol |
| LogP | 3.8768 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 421.17682 |
| Heavy Atoms | 29 |
| Complexity | 486.0 |
Chemical Identifiers
| CAS Number | 23853-82-9 |
|---|---|
| SMILES | CN(C1CCN(C1)C(=O)NC2=CC(=C(C(=C2)OC)OC)OC)C3=CC=CC=C3.Cl |
| InChIKey | CGMOQQCTESVVFM-UHFFFAOYSA-N |
Product Overview
3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride (CAS 23853-82-9), with molecular formula C21H28ClN3O4 and molecular weight 421.18 g/mol. IUPAC: 3-(N-methylanilino)-N-(3,4,5-trimethoxyphenyl)pyrrolidine-1-carboxamide;hydrochloride.
Chemical Property Profile of 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride
Property Insights of 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride
The XLogP value of 3.8768 indicates that 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride. Following Lipinski's Rule of Five, 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride has 2 hydrogen bond donor(s) and 5 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 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride?
The CAS number of 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride is 23853-82-9.
What is the molecular formula of 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride?
The molecular formula of 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride is C21H28ClN3O4.
What is the molecular weight of 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride?
The molecular weight of 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride is 421.18 g/mol.
Where can I buy 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride?
You can request a quote for 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-(N-Methylanilino)-3',4',5'-trimethoxy-1-pyrrolidinecarboxanilide hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.