1-Methyl-3-phenylpyrrolidin-3-yl propanoate
TL;DR: 1-Methyl-3-phenylpyrrolidin-3-yl propanoate (CAS 3188-69-0) is a chemical compound with molecular formula C14H19NO2 and molecular weight 233.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-methyl-3-phenylpyrrolidin-3-yl) propanoate
Also Known As: 1-Methyl-3-phenyl-3-pyrrolidinol propionate, 1-methyl-3-phenylpyrrolidin-3-yl propanoate, 1-methyl-3-phenyl-3-pyrrolidinyl propionate, 1-Methyl-3-phenylpyrrolidin-3-ol propionate, 3-Pyrrolidinol, 1-methyl-3-phenyl-, propionate (ester)
| Molecular Formula | C14H19NO2 |
|---|---|
| Molecular Weight | 233.14 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 233.14159 |
| Heavy Atoms | 17 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 3188-69-0 |
|---|---|
| SMILES | CCC(=O)OC1(CCN(C1)C)C2=CC=CC=C2 |
| InChIKey | HSCOGTOYLILNHR-UHFFFAOYSA-N |
Product Overview
1-Methyl-3-phenylpyrrolidin-3-yl propanoate (CAS 3188-69-0), with molecular formula C14H19NO2 and molecular weight 233.14 g/mol. IUPAC: (1-methyl-3-phenylpyrrolidin-3-yl) propanoate.
Chemical Property Profile of 1-Methyl-3-phenylpyrrolidin-3-yl propanoate
Property Insights of 1-Methyl-3-phenylpyrrolidin-3-yl propanoate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3-phenylpyrrolidin-3-yl propanoate. With a topological polar surface area (TPSA) of 29.5 Ų, 1-Methyl-3-phenylpyrrolidin-3-yl propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-3-phenylpyrrolidin-3-yl propanoate 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
Frequently Asked Questions
What is the CAS number of 1-Methyl-3-phenylpyrrolidin-3-yl propanoate?
The CAS number of 1-Methyl-3-phenylpyrrolidin-3-yl propanoate is 3188-69-0.
What is the molecular formula of 1-Methyl-3-phenylpyrrolidin-3-yl propanoate?
The molecular formula of 1-Methyl-3-phenylpyrrolidin-3-yl propanoate is C14H19NO2.
What is the molecular weight of 1-Methyl-3-phenylpyrrolidin-3-yl propanoate?
The molecular weight of 1-Methyl-3-phenylpyrrolidin-3-yl propanoate is 233.14 g/mol.
Where can I buy 1-Methyl-3-phenylpyrrolidin-3-yl propanoate?
You can request a quote for 1-Methyl-3-phenylpyrrolidin-3-yl propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-3-phenylpyrrolidin-3-yl propanoate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3-phenylpyrrolidin-3-yl propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.