N-benzyl-3-nitropyridin-2-amine
TL;DR: N-benzyl-3-nitropyridin-2-amine (CAS 3723-70-4) is a chemical compound with molecular formula C12H11N3O2 and molecular weight 229.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-3-nitropyridin-2-amine
Also Known As: N-benzyl-3-nitropyridin-2-amine, N-benzyl-3-nitro-2-pyridinamine, 2-benzylamino-3-nitropyridine, 3-nitro-2-benzylaminopyridine, N-benzyl-3-nitro-pyridin-2-amine
| Molecular Formula | C12H11N3O2 |
|---|---|
| Molecular Weight | 229.09 g/mol |
| LogP | 2.6019 |
| Topological Polar Surface Area | 68.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.08513 |
| Heavy Atoms | 17 |
| Complexity | 514.169 |
Chemical Identifiers
| CAS Number | 3723-70-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=C(C=CC=N2)[N+](=O)[O-] |
Product Overview
N-benzyl-3-nitropyridin-2-amine (CAS 3723-70-4), with molecular formula C12H11N3O2 and molecular weight 229.09 g/mol. IUPAC: N-benzyl-3-nitropyridin-2-amine.
Chemical Property Profile of N-benzyl-3-nitropyridin-2-amine
Property Insights of N-benzyl-3-nitropyridin-2-amine
The XLogP value of 2.6019 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-3-nitropyridin-2-amine. The TPSA of 68.06 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzyl-3-nitropyridin-2-amine. Following Lipinski's Rule of Five, N-benzyl-3-nitropyridin-2-amine 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-benzyl-3-nitropyridin-2-amine?
The CAS number of N-benzyl-3-nitropyridin-2-amine is 3723-70-4.
What is the molecular formula of N-benzyl-3-nitropyridin-2-amine?
The molecular formula of N-benzyl-3-nitropyridin-2-amine is C12H11N3O2.
What is the molecular weight of N-benzyl-3-nitropyridin-2-amine?
The molecular weight of N-benzyl-3-nitropyridin-2-amine is 229.09 g/mol.
Where can I buy N-benzyl-3-nitropyridin-2-amine?
You can request a quote for N-benzyl-3-nitropyridin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-3-nitropyridin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-3-nitropyridin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.