2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone
TL;DR: 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone (CAS 512787-29-0) is a chemical compound with molecular formula C13H17NO and molecular weight 203.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methylphenyl)-1-pyrrolidin-1-ylethanone
Also Known As: 1-[(2-methylphenyl)acetyl]pyrrolidine, 1-Pyrrolizino-2-(2-methylphenyl)ethanone, 2-(2-methylphenyl)-1-pyrrolidin-1-ylethanone, J1.851.346C, 2-(2-methylphenyl)-1-(pyrrolidin-1-yl)ethan-1-one
| Molecular Formula | C13H17NO |
|---|---|
| Molecular Weight | 203.13 g/mol |
| LogP | 2.15992 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.13101 |
| Heavy Atoms | 15 |
| Complexity | 353.3085 |
Chemical Identifiers
| CAS Number | 512787-29-0 |
|---|---|
| SMILES | CC1=CC=CC=C1CC(=O)N2CCCC2 |
Product Overview
2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone (CAS 512787-29-0), with molecular formula C13H17NO and molecular weight 203.13 g/mol. IUPAC: 2-(2-methylphenyl)-1-pyrrolidin-1-ylethanone.
Chemical Property Profile of 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone
Property Insights of 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone
The XLogP value of 2.15992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone. With a topological polar surface area (TPSA) of 20.31 Ų, 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone has 0 hydrogen bond donor(s) and 1 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-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone?
The CAS number of 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone is 512787-29-0.
What is the molecular formula of 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone?
The molecular formula of 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone is C13H17NO.
What is the molecular weight of 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone?
The molecular weight of 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone is 203.13 g/mol.
Where can I buy 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone?
You can request a quote for 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methylphenyl)-1-pyrrolidin-1-ylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.