1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one
TL;DR: 1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one (CAS 1373512-30-1) is a chemical compound with molecular formula C12H15NO2 and molecular weight 205.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzyl-5-(hydroxymethyl)pyrrolidin-2-one
Also Known As: 1-benzyl-5-(hydroxymethyl)pyrrolidin-2-one, (S)-1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one, (R)-1-BENZYL-5-HYDROXYMETHYL-2- PYRROLIDINONE, .alpha.-Pyrrolidone, N-benzyl-5-hydroxymethyl-, (5R)-1-benzyl-5-(hydroxymethyl)pyrrolidin-2-one
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H15NO2 |
| Molecular Weight | 205.11028 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.11028 Da |
| Heavy Atoms | 15 |
| Complexity | 224.0 |
| SMILES | C1CC(=O)N(C1CO)CC2=CC=CC=C2 |
| InChIKey | OECBQTBLDLREAV-UHFFFAOYSA-N |
Chemical Property Profile of 1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one
Property Insights of 1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one. With a topological polar surface area (TPSA) of 40.5 Ų, 1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-5-(hydroxymethyl)pyrrolidin-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-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one?
The CAS number of 1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one is 1373512-30-1.
What is the molecular formula of 1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one?
The molecular formula of 1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one is C12H15NO2.
What is the molecular weight of 1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one?
The molecular weight of 1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one is 205.11028 g/mol.
Where can I buy 1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one?
You can request a quote for 1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one?
Yes, CoreyChem provides custom synthesis services for 1-Benzyl-5-(hydroxymethyl)pyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.