1-(4-Aminophenyl)-5-methylpyrrolidin-2-one
TL;DR: 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one (CAS 13691-28-6) is a chemical compound with molecular formula C11H14N2O and molecular weight 190.11061 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-aminophenyl)-5-methylpyrrolidin-2-one
Also Known As: 1-(4-aminophenyl)-5-methylpyrrolidin-2-one, 1-(4-aminophenyl)-5-methyl-2-pyrrolidinone, 2-Pyrrolidinone,1-(4-aminophenyl)-5-methyl-, 4013AD, 1-(4-aminophenyl)-5-methyl-pyrrolidin-2-one
Technical Specifications
| Molecular Formula | C11H14N2O |
| Molecular Weight | 190.11061 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 46.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.11061 Da |
| Heavy Atoms | 14 |
| Complexity | 221.0 |
| SMILES | CC1CCC(=O)N1C2=CC=C(C=C2)N |
| InChIKey | WVPDRVCSLZCQAW-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one
Property Insights of 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one. With a topological polar surface area (TPSA) of 46.3 Ų, 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one?
The CAS number of 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one is 13691-28-6.
What is the molecular formula of 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one?
The molecular formula of 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one is C11H14N2O.
What is the molecular weight of 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one?
The molecular weight of 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one is 190.11061 g/mol.
Where can I buy 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one?
You can request a quote for 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one?
Yes, CoreyChem provides custom synthesis services for 1-(4-Aminophenyl)-5-methylpyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.