Pyrrolidine, 1-valeryl-
TL;DR: Pyrrolidine, 1-valeryl- (CAS 4419-57-2) is a chemical compound with molecular formula C9H17NO and molecular weight 155.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-pyrrolidin-1-ylpentan-1-one
Also Known As: Pyrrolidine, 1-valeryl-, 1-Valerylpyrrolidine, N-Valeryl-pyrrolidin, 1-Pentanoylpyrrolidine, valeric acid pyrrolidide
| Molecular Formula | C9H17NO |
|---|---|
| Molecular Weight | 155.13 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 155.13101 |
| Heavy Atoms | 11 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 4419-57-2 |
|---|---|
| SMILES | CCCCC(=O)N1CCCC1 |
| InChIKey | MWRDLBOZBMQUBD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyrrolidine, 1-valeryl- (CAS 4419-57-2), with molecular formula C9H17NO and molecular weight 155.13 g/mol. IUPAC: 1-pyrrolidin-1-ylpentan-1-one.
Chemical Property Profile of Pyrrolidine, 1-valeryl-
Property Insights of Pyrrolidine, 1-valeryl-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolidine, 1-valeryl-. With a topological polar surface area (TPSA) of 20.3 Ų, Pyrrolidine, 1-valeryl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidine, 1-valeryl- 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 Pyrrolidine, 1-valeryl-?
The CAS number of Pyrrolidine, 1-valeryl- is 4419-57-2.
What is the molecular formula of Pyrrolidine, 1-valeryl-?
The molecular formula of Pyrrolidine, 1-valeryl- is C9H17NO.
What is the molecular weight of Pyrrolidine, 1-valeryl-?
The molecular weight of Pyrrolidine, 1-valeryl- is 155.13 g/mol.
Where can I buy Pyrrolidine, 1-valeryl-?
You can request a quote for Pyrrolidine, 1-valeryl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidine, 1-valeryl-?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidine, 1-valeryl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.