2-cyano-N-pyridin-3-ylaziridine-1-carboxamide
TL;DR: 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide (CAS 219501-58-3) is a chemical compound with molecular formula C9H8N4O and molecular weight 188.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-N-pyridin-3-ylaziridine-1-carboxamide
Also Known As: 1-Aziridinecarboxamide, 2-cyano-N-3-pyridinyl-, J1.081.249F, N-(3-Pyridyl)-2-cyanoaziridine-1-carboxamide, 2-cyano-N-pyridin-3-yl-aziridine-1-carboxamide, 2-cyano-N-(pyridin-3-yl)aziridine-1-carboxamide
| Molecular Formula | C9H8N4O |
|---|---|
| Molecular Weight | 188.07 g/mol |
| LogP | 0.82128 |
| Topological Polar Surface Area | 68.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.06981 |
| Heavy Atoms | 14 |
| Complexity | 383.54846 |
Chemical Identifiers
| CAS Number | 219501-58-3 |
|---|---|
| SMILES | C1C(N1C(=O)NC2=CN=CC=C2)C#N |
Product Overview
2-cyano-N-pyridin-3-ylaziridine-1-carboxamide (CAS 219501-58-3), with molecular formula C9H8N4O and molecular weight 188.07 g/mol. IUPAC: 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide.
Chemical Property Profile of 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide
Property Insights of 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide
The XLogP value of 0.82128 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide. The TPSA of 68.79 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide. Following Lipinski's Rule of Five, 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide has 1 hydrogen bond donor(s) and 3 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 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide?
The CAS number of 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide is 219501-58-3.
What is the molecular formula of 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide?
The molecular formula of 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide is C9H8N4O.
What is the molecular weight of 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide?
The molecular weight of 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide is 188.07 g/mol.
Where can I buy 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide?
You can request a quote for 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-N-pyridin-3-ylaziridine-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.