N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide
TL;DR: N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide (CAS 5367-39-5) is a chemical compound with molecular formula C12H15N3O3 and molecular weight 249.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide
Also Known As: N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide, N-Acetyl-4-pyrrolidino-3-nitro-anilin, N-[5-Nitro-2-(1-pyrrolidinyl)phenyl]acetamide, 5'-nitro-2'-(1-pyrrolidinyl)-acetanilide, N-(5-Nitro-2-(pyrrolidin-1-yl)phenyl)acetamide
| Molecular Formula | C12H15N3O3 |
|---|---|
| Molecular Weight | 249.11 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 78.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.11134 |
| Heavy Atoms | 18 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 5367-39-5 |
|---|---|
| SMILES | CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])N2CCCC2 |
| InChIKey | GMZZEDGQXDPDGH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide (CAS 5367-39-5), with molecular formula C12H15N3O3 and molecular weight 249.11 g/mol. IUPAC: N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide.
Chemical Property Profile of N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide
Property Insights of N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide. The TPSA of 78.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide. Following Lipinski's Rule of Five, N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide has 1 hydrogen bond donor(s) and 4 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 N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide?
The CAS number of N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide is 5367-39-5.
What is the molecular formula of N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide?
The molecular formula of N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide is C12H15N3O3.
What is the molecular weight of N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide?
The molecular weight of N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide is 249.11 g/mol.
Where can I buy N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide?
You can request a quote for N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-nitro-2-pyrrolidin-1-ylphenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.