![2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile structure](/static/products/2569/256958-79-9.webp)
2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile
TL;DR: 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile (CAS 256958-79-9) is a chemical compound with molecular formula C14H18N4O2 and molecular weight 274.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile
Also Known As: 2-methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile, 2-methyl-2-[4-(4-nitrophenyl)piperazino]propanenitrile, 2-Methyl-2-[4-(4-nitrophenyl)piperazino] propanenitrile, 5E-082
| Molecular Formula | C14H18N4O2 |
|---|---|
| Molecular Weight | 274.14 g/mol |
| LogP | 2.01898 |
| Topological Polar Surface Area | 73.41 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.14297 |
| Heavy Atoms | 20 |
| Complexity | 525.10004 |
Chemical Identifiers
| CAS Number | 256958-79-9 |
|---|---|
| SMILES | CC(C)(C#N)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile (CAS 256958-79-9), with molecular formula C14H18N4O2 and molecular weight 274.14 g/mol. IUPAC: 2-methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile.
Chemical Property Profile of 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile
Property Insights of 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile
The XLogP value of 2.01898 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile. The TPSA of 73.41 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile. Following Lipinski's Rule of Five, 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile has 0 hydrogen bond donor(s) and 5 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-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile?
The CAS number of 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile is 256958-79-9.
What is the molecular formula of 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile?
The molecular formula of 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile is C14H18N4O2.
What is the molecular weight of 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile?
The molecular weight of 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile is 274.14 g/mol.
Where can I buy 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile?
You can request a quote for 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.