N1-(2-cyanophenyl)-N2-isopropyloxalamide
TL;DR: N1-(2-cyanophenyl)-N2-isopropyloxalamide (CAS 898356-02-0) 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'-propan-2-yloxamide
Also Known As: N1-(2-cyanophenyl)-N2-isopropyloxalamide, N-(2-cyanophenyl)-N'-propan-2-yloxamide, N'-(2-cyanophenyl)-N-(propan-2-yl)ethanediamide, F2616-0361
| Molecular Formula | C12H13N3O2 |
|---|---|
| Molecular Weight | 231.10 g/mol |
| LogP | 1.02138 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.10077 |
| Heavy Atoms | 17 |
| Complexity | 474.88425 |
Chemical Identifiers
| CAS Number | 898356-02-0 |
|---|---|
| SMILES | CC(C)NC(=O)C(=O)NC1=CC=CC=C1C#N |
Product Overview
N1-(2-cyanophenyl)-N2-isopropyloxalamide (CAS 898356-02-0), with molecular formula C12H13N3O2 and molecular weight 231.10 g/mol. IUPAC: N-(2-cyanophenyl)-N'-propan-2-yloxamide.
Chemical Property Profile of N1-(2-cyanophenyl)-N2-isopropyloxalamide
Property Insights of N1-(2-cyanophenyl)-N2-isopropyloxalamide
The XLogP value of 1.02138 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-(2-cyanophenyl)-N2-isopropyloxalamide. The TPSA of 81.99 Ų falls within the moderate polarity range, balancing permeability and solubility for N1-(2-cyanophenyl)-N2-isopropyloxalamide. Following Lipinski's Rule of Five, N1-(2-cyanophenyl)-N2-isopropyloxalamide 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-isopropyloxalamide?
The CAS number of N1-(2-cyanophenyl)-N2-isopropyloxalamide is 898356-02-0.
What is the molecular formula of N1-(2-cyanophenyl)-N2-isopropyloxalamide?
The molecular formula of N1-(2-cyanophenyl)-N2-isopropyloxalamide is C12H13N3O2.
What is the molecular weight of N1-(2-cyanophenyl)-N2-isopropyloxalamide?
The molecular weight of N1-(2-cyanophenyl)-N2-isopropyloxalamide is 231.10 g/mol.
Where can I buy N1-(2-cyanophenyl)-N2-isopropyloxalamide?
You can request a quote for N1-(2-cyanophenyl)-N2-isopropyloxalamide 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-isopropyloxalamide?
Yes, KEHONG BIO provides custom synthesis services for N1-(2-cyanophenyl)-N2-isopropyloxalamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.