N1-(2-cyanophenyl)-N2-propyloxalamide
TL;DR: N1-(2-cyanophenyl)-N2-propyloxalamide (CAS 898349-44-5) is a chemical compound with molecular formula C12H13N3O2 and molecular weight 231.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(2-cyanophenyl)-N-propyloxamide
Also Known As: N'-(2-cyanophenyl)-N-propyloxamide, N1-(2-cyanophenyl)-N2-propyloxalamide, N'-(2-cyanophenyl)-N-propylethanediamide, F2616-0322
| Molecular Formula | C12H13N3O2 |
|---|---|
| Molecular Weight | 231.10 g/mol |
| LogP | 1.02298 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.10077 |
| Heavy Atoms | 17 |
| Complexity | 463.0637 |
Chemical Identifiers
| CAS Number | 898349-44-5 |
|---|---|
| SMILES | CCCNC(=O)C(=O)NC1=CC=CC=C1C#N |
Product Overview
N1-(2-cyanophenyl)-N2-propyloxalamide (CAS 898349-44-5), with molecular formula C12H13N3O2 and molecular weight 231.10 g/mol. IUPAC: N'-(2-cyanophenyl)-N-propyloxamide.
Chemical Property Profile of N1-(2-cyanophenyl)-N2-propyloxalamide
Property Insights of N1-(2-cyanophenyl)-N2-propyloxalamide
The XLogP value of 1.02298 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-(2-cyanophenyl)-N2-propyloxalamide. The TPSA of 81.99 Ų falls within the moderate polarity range, balancing permeability and solubility for N1-(2-cyanophenyl)-N2-propyloxalamide. Following Lipinski's Rule of Five, N1-(2-cyanophenyl)-N2-propyloxalamide has 2 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 N1-(2-cyanophenyl)-N2-propyloxalamide?
The CAS number of N1-(2-cyanophenyl)-N2-propyloxalamide is 898349-44-5.
What is the molecular formula of N1-(2-cyanophenyl)-N2-propyloxalamide?
The molecular formula of N1-(2-cyanophenyl)-N2-propyloxalamide is C12H13N3O2.
What is the molecular weight of N1-(2-cyanophenyl)-N2-propyloxalamide?
The molecular weight of N1-(2-cyanophenyl)-N2-propyloxalamide is 231.10 g/mol.
Where can I buy N1-(2-cyanophenyl)-N2-propyloxalamide?
You can request a quote for N1-(2-cyanophenyl)-N2-propyloxalamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-(2-cyanophenyl)-N2-propyloxalamide?
Yes, KEHONG BIO provides custom synthesis services for N1-(2-cyanophenyl)-N2-propyloxalamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.