Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel-
TL;DR: Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel- (CAS 71732-80-4) is a chemical compound with molecular formula C15H31N and molecular weight 225.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,5R)-2-butyl-5-heptylpyrrolidine
Also Known As: (2R,5R)-2-butyl-5-heptylpyrrolidine, Pyrrolidine, 2-butyl-5-heptyl-, 2alpha-Butyl-5beta-heptylpyrrolidine, (2r-trans)-2-butyl-5-heptylpyrrolidine, Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel-
| Molecular Formula | C15H31N |
|---|---|
| Molecular Weight | 225.25 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Exact Mass | 225.24565 |
| Heavy Atoms | 16 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 71732-80-4 |
|---|---|
| SMILES | CCCCCCC[C@@H]1CC[C@H](N1)CCCC |
| InChIKey | FIXZYWKWWCBXRZ-HUUCEWRRSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel- (CAS 71732-80-4), with molecular formula C15H31N and molecular weight 225.25 g/mol. IUPAC: (2R,5R)-2-butyl-5-heptylpyrrolidine.
Chemical Property Profile of Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel-
Property Insights of Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel-
The XLogP value of 5.6 indicates that Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel- has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel-?
The CAS number of Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel- is 71732-80-4.
What is the molecular formula of Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel-?
The molecular formula of Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel- is C15H31N.
What is the molecular weight of Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel-?
The molecular weight of Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel- is 225.25 g/mol.
Where can I buy Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel-?
You can request a quote for Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel-?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidine, 2-butyl-5-heptyl-, (2R,5R)-rel- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.