Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)-
TL;DR: Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)- (CAS 6062-15-3) is a chemical compound with molecular formula C15H19NO and molecular weight 229.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-phenylmethoxybut-2-ynyl)pyrrolidine
Also Known As: Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)-, 1-(4-(Benzyloxy)-2-butynyl)pyrrolidine, Pyrrolidine, 1-(4-(phenylmethoxy)-2-butynyl)-, 1-(4-phenylmethoxybut-2-ynyl)pyrrolidine, 1-[4-(benzyloxy)but-2-yn-1-yl]pyrrolidine
| Molecular Formula | C15H19NO |
|---|---|
| Molecular Weight | 229.15 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.14667 |
| Heavy Atoms | 17 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 6062-15-3 |
|---|---|
| SMILES | C1CCN(C1)CC#CCOCC2=CC=CC=C2 |
| InChIKey | APIKLEVPMDVPNN-UHFFFAOYSA-N |
Product Overview
Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)- (CAS 6062-15-3), with molecular formula C15H19NO and molecular weight 229.15 g/mol. IUPAC: 1-(4-phenylmethoxybut-2-ynyl)pyrrolidine.
Chemical Property Profile of Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)-
Property Insights of Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)-. With a topological polar surface area (TPSA) of 12.5 Ų, Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)- has 0 hydrogen bond donor(s) and 2 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-(4-(benzyloxy)-2-butynyl)-?
The CAS number of Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)- is 6062-15-3.
What is the molecular formula of Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)-?
The molecular formula of Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)- is C15H19NO.
What is the molecular weight of Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)-?
The molecular weight of Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)- is 229.15 g/mol.
Where can I buy Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)-?
You can request a quote for Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidine, 1-(4-(benzyloxy)-2-butynyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.