N-benzyl-N-methyl-5-nitropyridin-2-amine
TL;DR: N-benzyl-N-methyl-5-nitropyridin-2-amine (CAS 181114-66-9) is a chemical compound with molecular formula C13H13N3O2 and molecular weight 243.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-N-methyl-5-nitropyridin-2-amine
Also Known As: N-benzyl-N-methyl-5-nitropyridin-2-amine, N-benzyl-N-methyl-5-nitro-pyridin-2-amine
| Molecular Formula | C13H13N3O2 |
|---|---|
| Molecular Weight | 243.10 g/mol |
| LogP | 2.6262 |
| Topological Polar Surface Area | 59.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 243.10077 |
| Heavy Atoms | 18 |
| Complexity | 525.69244 |
Chemical Identifiers
| CAS Number | 181114-66-9 |
|---|---|
| SMILES | CN(CC1=CC=CC=C1)C2=NC=C(C=C2)[N+](=O)[O-] |
Product Overview
N-benzyl-N-methyl-5-nitropyridin-2-amine (CAS 181114-66-9), with molecular formula C13H13N3O2 and molecular weight 243.10 g/mol. IUPAC: N-benzyl-N-methyl-5-nitropyridin-2-amine.
Chemical Property Profile of N-benzyl-N-methyl-5-nitropyridin-2-amine
Property Insights of N-benzyl-N-methyl-5-nitropyridin-2-amine
The XLogP value of 2.6262 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-N-methyl-5-nitropyridin-2-amine. With a topological polar surface area (TPSA) of 59.27 Ų, N-benzyl-N-methyl-5-nitropyridin-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-N-methyl-5-nitropyridin-2-amine has 0 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-N-methyl-5-nitropyridin-2-amine?
The CAS number of N-benzyl-N-methyl-5-nitropyridin-2-amine is 181114-66-9.
What is the molecular formula of N-benzyl-N-methyl-5-nitropyridin-2-amine?
The molecular formula of N-benzyl-N-methyl-5-nitropyridin-2-amine is C13H13N3O2.
What is the molecular weight of N-benzyl-N-methyl-5-nitropyridin-2-amine?
The molecular weight of N-benzyl-N-methyl-5-nitropyridin-2-amine is 243.10 g/mol.
Where can I buy N-benzyl-N-methyl-5-nitropyridin-2-amine?
You can request a quote for N-benzyl-N-methyl-5-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-N-methyl-5-nitropyridin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-N-methyl-5-nitropyridin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.