2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl-
TL;DR: 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl- (CAS 97561-91-6) is a chemical compound with molecular formula C14H18FNO and molecular weight 235.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-fluorophenyl)methyl]-1,3,3-trimethylpyrrolidin-2-one
Also Known As: SR 41872, 5-((4-Fluorophenyl)methyl)-1,3,3-trimethyl-2-pyrrolidinone, (Fluoro-4 phenyl)methyl-5 trimethyl-1,3,3 pyrrolidone-2, 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl-, (Fluoro-4 phenyl)methyl-5 trimethyl-1,3,3 pyrrolidone-2 [French]
| Molecular Formula | C14H18FNO |
|---|---|
| Molecular Weight | 235.14 g/mol |
| LogP | 2.6251 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.13724 |
| Heavy Atoms | 17 |
| Complexity | 424.35327 |
Chemical Identifiers
| CAS Number | 97561-91-6 |
|---|---|
| SMILES | CC1(CC(N(C1=O)C)CC2=CC=C(C=C2)F)C |
Product Overview
2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl- (CAS 97561-91-6), with molecular formula C14H18FNO and molecular weight 235.14 g/mol. IUPAC: 5-[(4-fluorophenyl)methyl]-1,3,3-trimethylpyrrolidin-2-one.
Chemical Property Profile of 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl-
Property Insights of 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl-
The XLogP value of 2.6251 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl-. With a topological polar surface area (TPSA) of 20.31 Ų, 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl- 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-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl-?
The CAS number of 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl- is 97561-91-6.
What is the molecular formula of 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl-?
The molecular formula of 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl- is C14H18FNO.
What is the molecular weight of 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl-?
The molecular weight of 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl- is 235.14 g/mol.
Where can I buy 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl-?
You can request a quote for 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrrolidinone, 5-((4-fluorophenyl)methyl)-1,3,3-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.