1-Ethyl-2-(2-isocyanoethyl)pyrrolidine
TL;DR: 1-Ethyl-2-(2-isocyanoethyl)pyrrolidine (CAS 602268-97-3) is a chemical compound with molecular formula C9H16N2 and molecular weight 152.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-2-(2-isocyanoethyl)pyrrolidine
Also Known As: 1-ethyl-2-(2-isocyanoethyl)pyrrolidine, Pyrrolidine, 1-ethyl-2-(2-isocyanoethyl)- (9CI)
| Molecular Formula | C9H16N2 |
|---|---|
| Molecular Weight | 152.13 g/mol |
| LogP | 1.78009 |
| Topological Polar Surface Area | 7.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 152.13135 |
| Heavy Atoms | 11 |
| Complexity | 148.13194 |
Chemical Identifiers
| CAS Number | 602268-97-3 |
|---|---|
| SMILES | CCN1CCCC1CC[N+]#[C-] |
Product Overview
1-Ethyl-2-(2-isocyanoethyl)pyrrolidine (CAS 602268-97-3), with molecular formula C9H16N2 and molecular weight 152.13 g/mol. IUPAC: 1-ethyl-2-(2-isocyanoethyl)pyrrolidine.
Chemical Property Profile of 1-Ethyl-2-(2-isocyanoethyl)pyrrolidine
Property Insights of 1-Ethyl-2-(2-isocyanoethyl)pyrrolidine
The XLogP value of 1.78009 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl-2-(2-isocyanoethyl)pyrrolidine. With a topological polar surface area (TPSA) of 7.6 Ų, 1-Ethyl-2-(2-isocyanoethyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethyl-2-(2-isocyanoethyl)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-Ethyl-2-(2-isocyanoethyl)pyrrolidine?
The CAS number of 1-Ethyl-2-(2-isocyanoethyl)pyrrolidine is 602268-97-3.
What is the molecular formula of 1-Ethyl-2-(2-isocyanoethyl)pyrrolidine?
The molecular formula of 1-Ethyl-2-(2-isocyanoethyl)pyrrolidine is C9H16N2.
What is the molecular weight of 1-Ethyl-2-(2-isocyanoethyl)pyrrolidine?
The molecular weight of 1-Ethyl-2-(2-isocyanoethyl)pyrrolidine is 152.13 g/mol.
Where can I buy 1-Ethyl-2-(2-isocyanoethyl)pyrrolidine?
You can request a quote for 1-Ethyl-2-(2-isocyanoethyl)pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl-2-(2-isocyanoethyl)pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-2-(2-isocyanoethyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.