(3-Methylphenyl)-1-pyrrolidinylmethanone
TL;DR: (3-Methylphenyl)-1-pyrrolidinylmethanone (CAS 164918-75-6) is a chemical compound with molecular formula C12H15NO and molecular weight 189.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methylphenyl)-pyrrolidin-1-ylmethanone
Also Known As: 1-(3-Methylbenzoyl)pyrrolidine, starbld0003049, Pyrrolidin-1-yl(m-tolyl)methanone, (3-methylphenyl)-pyrrolidin-1-ylmethanone, 3-methylphenyl pyrrolidinyl ketone
| Molecular Formula | C12H15NO |
|---|---|
| Molecular Weight | 189.12 g/mol |
| LogP | 2.23102 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.11537 |
| Heavy Atoms | 14 |
| Complexity | 339.9299 |
Chemical Identifiers
| CAS Number | 164918-75-6 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)N2CCCC2 |
Product Overview
(3-Methylphenyl)-1-pyrrolidinylmethanone (CAS 164918-75-6), with molecular formula C12H15NO and molecular weight 189.12 g/mol. IUPAC: (3-methylphenyl)-pyrrolidin-1-ylmethanone.
Chemical Property Profile of (3-Methylphenyl)-1-pyrrolidinylmethanone
Property Insights of (3-Methylphenyl)-1-pyrrolidinylmethanone
The XLogP value of 2.23102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Methylphenyl)-1-pyrrolidinylmethanone. With a topological polar surface area (TPSA) of 20.31 Ų, (3-Methylphenyl)-1-pyrrolidinylmethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Methylphenyl)-1-pyrrolidinylmethanone 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 (3-Methylphenyl)-1-pyrrolidinylmethanone?
The CAS number of (3-Methylphenyl)-1-pyrrolidinylmethanone is 164918-75-6.
What is the molecular formula of (3-Methylphenyl)-1-pyrrolidinylmethanone?
The molecular formula of (3-Methylphenyl)-1-pyrrolidinylmethanone is C12H15NO.
What is the molecular weight of (3-Methylphenyl)-1-pyrrolidinylmethanone?
The molecular weight of (3-Methylphenyl)-1-pyrrolidinylmethanone is 189.12 g/mol.
Where can I buy (3-Methylphenyl)-1-pyrrolidinylmethanone?
You can request a quote for (3-Methylphenyl)-1-pyrrolidinylmethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Methylphenyl)-1-pyrrolidinylmethanone?
Yes, KEHONG BIO provides custom synthesis services for (3-Methylphenyl)-1-pyrrolidinylmethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.