![N-[3-(dimethylamino)propyl]-4-nitrobenzamide structure](/static/products/884/88452-44-2.png)
N-[3-(dimethylamino)propyl]-4-nitrobenzamide
TL;DR: N-[3-(dimethylamino)propyl]-4-nitrobenzamide (CAS 88452-44-2) is a chemical compound with molecular formula C12H17N3O3 and molecular weight 251.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(dimethylamino)propyl]-4-nitrobenzamide
Also Known As: N-[3-(dimethylamino)propyl]-4-nitrobenzamide, Benzamide, N-[3-(dimethylamino)propyl]-4-nitro-, N-[3-(dimethylamino)propyl](4-nitrophenyl)carboxamide, 3-[(3-chlorophenyl)-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester, Cambridge id 5562858
| Molecular Formula | C12H17N3O3 |
|---|---|
| Molecular Weight | 251.13 g/mol |
| LogP | 1.2763 |
| Topological Polar Surface Area | 75.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 251.127 |
| Heavy Atoms | 18 |
| Complexity | 415.08075 |
Chemical Identifiers
| CAS Number | 88452-44-2 |
|---|---|
| SMILES | CN(C)CCCNC(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
N-[3-(dimethylamino)propyl]-4-nitrobenzamide (CAS 88452-44-2), with molecular formula C12H17N3O3 and molecular weight 251.13 g/mol. IUPAC: N-[3-(dimethylamino)propyl]-4-nitrobenzamide.
Chemical Property Profile of N-[3-(dimethylamino)propyl]-4-nitrobenzamide
Property Insights of N-[3-(dimethylamino)propyl]-4-nitrobenzamide
The XLogP value of 1.2763 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[3-(dimethylamino)propyl]-4-nitrobenzamide. The TPSA of 75.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-(dimethylamino)propyl]-4-nitrobenzamide. Following Lipinski's Rule of Five, N-[3-(dimethylamino)propyl]-4-nitrobenzamide 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-[3-(dimethylamino)propyl]-4-nitrobenzamide?
The CAS number of N-[3-(dimethylamino)propyl]-4-nitrobenzamide is 88452-44-2.
What is the molecular formula of N-[3-(dimethylamino)propyl]-4-nitrobenzamide?
The molecular formula of N-[3-(dimethylamino)propyl]-4-nitrobenzamide is C12H17N3O3.
What is the molecular weight of N-[3-(dimethylamino)propyl]-4-nitrobenzamide?
The molecular weight of N-[3-(dimethylamino)propyl]-4-nitrobenzamide is 251.13 g/mol.
Where can I buy N-[3-(dimethylamino)propyl]-4-nitrobenzamide?
You can request a quote for N-[3-(dimethylamino)propyl]-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-(dimethylamino)propyl]-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(dimethylamino)propyl]-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.