1-(3-Butenyl)pyrrolidine
TL;DR: 1-(3-Butenyl)pyrrolidine (CAS 94092-91-8) is a chemical compound with molecular formula C8H15N and molecular weight 125.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-but-3-enylpyrrolidine
Also Known As: 1-(but-3-en-1-yl)pyrrolidine, 1-but-3-enylpyrrolidine, 1-(3-Butenyl)Pyrrolidine, N-homoallylpyrrolidine, (3-butenyl)pyrrolidine
| Molecular Formula | C8H15N |
|---|---|
| Molecular Weight | 125.12 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 125.12045 |
| Heavy Atoms | 9 |
| Complexity | 82.0 |
Chemical Identifiers
| CAS Number | 94092-91-8 |
|---|---|
| SMILES | C=CCCN1CCCC1 |
| InChIKey | FOUQITQNYKZCHC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(3-Butenyl)pyrrolidine (CAS 94092-91-8), with molecular formula C8H15N and molecular weight 125.12 g/mol. IUPAC: 1-but-3-enylpyrrolidine.
Chemical Property Profile of 1-(3-Butenyl)pyrrolidine
Property Insights of 1-(3-Butenyl)pyrrolidine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Butenyl)pyrrolidine. With a topological polar surface area (TPSA) of 3.2 Ų, 1-(3-Butenyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Butenyl)pyrrolidine 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 1-(3-Butenyl)pyrrolidine?
The CAS number of 1-(3-Butenyl)pyrrolidine is 94092-91-8.
What is the molecular formula of 1-(3-Butenyl)pyrrolidine?
The molecular formula of 1-(3-Butenyl)pyrrolidine is C8H15N.
What is the molecular weight of 1-(3-Butenyl)pyrrolidine?
The molecular weight of 1-(3-Butenyl)pyrrolidine is 125.12 g/mol.
Where can I buy 1-(3-Butenyl)pyrrolidine?
You can request a quote for 1-(3-Butenyl)pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Butenyl)pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Butenyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.