5-甲基吡咯烷-2-甲酸
TL;DR: 5-甲基吡咯烷-2-甲酸 (CAS 681128-94-9) is a chemical compound with molecular formula C6H11NO2 and molecular weight 129.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-甲基吡咯烷-2-甲酸
5-methylpyrrolidine-2-carboxylic acid
Also Known As: 5-methylpyrrolidine-2-carboxylic acid, 5-Methylproline, cis-5-methylproline, 5-methyl-dl-proline, Proline, 5-methyl-
| Molecular Formula | C6H11NO2 |
|---|---|
| Molecular Weight | 129.08 g/mol |
| LogP | -1.9 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 129.07898 |
| Heavy Atoms | 9 |
| Complexity | 124.0 |
Chemical Identifiers
| CAS Number | 681128-94-9 |
|---|---|
| SMILES | CC1CCC(N1)C(=O)O |
| InChIKey | YNSYWEFVEIFJPZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-甲基吡咯烷-2-甲酸 (CAS 681128-94-9), with molecular formula C6H11NO2 and molecular weight 129.08 g/mol. IUPAC: 5-methylpyrrolidine-2-carboxylic acid.
Chemical Property Profile of 5-甲基吡咯烷-2-甲酸
Property Insights of 5-甲基吡咯烷-2-甲酸
The XLogP value of -1.9 indicates that 5-甲基吡咯烷-2-甲酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.3 Ų, 5-甲基吡咯烷-2-甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-甲基吡咯烷-2-甲酸 has 2 hydrogen bond donor(s) and 3 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 5-甲基吡咯烷-2-甲酸?
The CAS number of 5-甲基吡咯烷-2-甲酸 is 681128-94-9.
What is the molecular formula of 5-甲基吡咯烷-2-甲酸?
The molecular formula of 5-甲基吡咯烷-2-甲酸 is C6H11NO2.
What is the molecular weight of 5-甲基吡咯烷-2-甲酸?
The molecular weight of 5-甲基吡咯烷-2-甲酸 is 129.08 g/mol.
Where can I buy 5-甲基吡咯烷-2-甲酸?
You can request a quote for 5-甲基吡咯烷-2-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-甲基吡咯烷-2-甲酸?
Yes, KEHONG BIO provides custom synthesis services for 5-甲基吡咯烷-2-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.