Pyrrolidine, 1-(2-methylpropyl)-
TL;DR: Pyrrolidine, 1-(2-methylpropyl)- (CAS 39198-81-7) is a chemical compound with molecular formula C8H17N and molecular weight 127.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methylpropyl)pyrrolidine
Also Known As: N-isobutylpyrrolidine, 1-isobutylpyrrolidine, 1-Isobutyl-pyrrolidine, 1-(2-methylpropyl)pyrrolidine, pyrrolidine, 1-isobutyl-
| Molecular Formula | C8H17N |
|---|---|
| Molecular Weight | 127.14 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 127.1361 |
| Heavy Atoms | 9 |
| Complexity | 72.0 |
Chemical Identifiers
| CAS Number | 39198-81-7 |
|---|---|
| SMILES | CC(C)CN1CCCC1 |
| InChIKey | KOFIDSXHWGFEMO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyrrolidine, 1-(2-methylpropyl)- (CAS 39198-81-7), with molecular formula C8H17N and molecular weight 127.14 g/mol. IUPAC: 1-(2-methylpropyl)pyrrolidine.
Chemical Property Profile of Pyrrolidine, 1-(2-methylpropyl)-
Property Insights of Pyrrolidine, 1-(2-methylpropyl)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolidine, 1-(2-methylpropyl)-. With a topological polar surface area (TPSA) of 3.2 Ų, Pyrrolidine, 1-(2-methylpropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidine, 1-(2-methylpropyl)- 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-(2-methylpropyl)-?
The CAS number of Pyrrolidine, 1-(2-methylpropyl)- is 39198-81-7.
What is the molecular formula of Pyrrolidine, 1-(2-methylpropyl)-?
The molecular formula of Pyrrolidine, 1-(2-methylpropyl)- is C8H17N.
What is the molecular weight of Pyrrolidine, 1-(2-methylpropyl)-?
The molecular weight of Pyrrolidine, 1-(2-methylpropyl)- is 127.14 g/mol.
Where can I buy Pyrrolidine, 1-(2-methylpropyl)-?
You can request a quote for Pyrrolidine, 1-(2-methylpropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidine, 1-(2-methylpropyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidine, 1-(2-methylpropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.