2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone
TL;DR: 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone (CAS 827331-98-6) is a chemical compound with molecular formula C18H26N2O2 and molecular weight 302.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone
Also Known As: AT-057/43468772, 1-[(4-methylphenoxy)acetyl]-4-(1-pyrrolidinyl)piperidine, 2-(4-methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone, 2-(4-methylphenoxy)-1-[4-(pyrrolidin-1-yl)piperidin-1-yl]ethanone, 2-(4-methylphenoxy)-1-(4-pyrrolidinylpiperidyl)ethan-1-one
| Molecular Formula | C18H26N2O2 |
|---|---|
| Molecular Weight | 302.20 g/mol |
| LogP | 2.46062 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.19943 |
| Heavy Atoms | 22 |
| Complexity | 486.31354 |
Chemical Identifiers
| CAS Number | 827331-98-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCC(=O)N2CCC(CC2)N3CCCC3 |
Product Overview
2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone (CAS 827331-98-6), with molecular formula C18H26N2O2 and molecular weight 302.20 g/mol. IUPAC: 2-(4-methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone.
Chemical Property Profile of 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone
Property Insights of 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone
The XLogP value of 2.46062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone. With a topological polar surface area (TPSA) of 32.78 Ų, 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone 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 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone?
The CAS number of 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone is 827331-98-6.
What is the molecular formula of 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone?
The molecular formula of 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone is C18H26N2O2.
What is the molecular weight of 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone?
The molecular weight of 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone is 302.20 g/mol.
Where can I buy 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone?
You can request a quote for 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methylphenoxy)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.