2-(2-Iminopyrrolidin-1-yl)acetonitrile
TL;DR: 2-(2-Iminopyrrolidin-1-yl)acetonitrile (CAS 151602-27-6) is a chemical compound with molecular formula C6H9N3 and molecular weight 123.07965 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-iminopyrrolidin-1-yl)acetonitrile
Also Known As: 2-(2-iminopyrrolidin-1-yl)acetonitrile, 1-Pyrrolidineacetonitrile,2-imino-(9CI), 1-PYRROLIDINEACETONITRILE, 2-IMINO-, 1-Pyrrolidineacetonitrile, 2-imino- (9CI)
Technical Specifications
| Molecular Formula | C6H9N3 |
| Molecular Weight | 123.07965 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 50.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 123.07965 Da |
| Heavy Atoms | 9 |
| Complexity | 164.0 |
| SMILES | C1CC(=N)N(C1)CC#N |
| InChIKey | XBNNPSILSFYNEU-UHFFFAOYSA-N |
Chemical Property Profile of 2-(2-Iminopyrrolidin-1-yl)acetonitrile
Property Insights of 2-(2-Iminopyrrolidin-1-yl)acetonitrile
The XLogP value of -0.3 indicates that 2-(2-Iminopyrrolidin-1-yl)acetonitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 50.9 Ų, 2-(2-Iminopyrrolidin-1-yl)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Iminopyrrolidin-1-yl)acetonitrile has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(2-Iminopyrrolidin-1-yl)acetonitrile?
The CAS number of 2-(2-Iminopyrrolidin-1-yl)acetonitrile is 151602-27-6.
What is the molecular formula of 2-(2-Iminopyrrolidin-1-yl)acetonitrile?
The molecular formula of 2-(2-Iminopyrrolidin-1-yl)acetonitrile is C6H9N3.
What is the molecular weight of 2-(2-Iminopyrrolidin-1-yl)acetonitrile?
The molecular weight of 2-(2-Iminopyrrolidin-1-yl)acetonitrile is 123.07965 g/mol.
Where can I buy 2-(2-Iminopyrrolidin-1-yl)acetonitrile?
You can request a quote for 2-(2-Iminopyrrolidin-1-yl)acetonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(2-Iminopyrrolidin-1-yl)acetonitrile?
Yes, CoreyChem provides custom synthesis services for 2-(2-Iminopyrrolidin-1-yl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.