N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine
TL;DR: N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine (CAS 94166-54-8) is a chemical compound with molecular formula C12H14N4O2 and molecular weight 246.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1,5-dimethylpyrrol-2-yl)methyl]-5-nitropyridin-2-amine
Also Known As: EINECS 303-350-5, n-[methyl]-5-nitropyridin-2-amine, N-[ methyl]-5-nitropyridin-2-amine, N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine, N-[(1,5-dimethyl-1H-pyrrol-2-yl)methyl]-5-nitropyridin-2-amine
| Molecular Formula | C12H14N4O2 |
|---|---|
| Molecular Weight | 246.11 g/mol |
| LogP | 2.24882 |
| Topological Polar Surface Area | 72.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.11168 |
| Heavy Atoms | 18 |
| Complexity | 559.9564 |
Chemical Identifiers
| CAS Number | 94166-54-8 |
|---|---|
| SMILES | CC1=CC=C(N1C)CNC2=NC=C(C=C2)[N+](=O)[O-] |
Product Overview
N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine (CAS 94166-54-8), with molecular formula C12H14N4O2 and molecular weight 246.11 g/mol. IUPAC: N-[(1,5-dimethylpyrrol-2-yl)methyl]-5-nitropyridin-2-amine.
Chemical Property Profile of N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine
Property Insights of N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine
The XLogP value of 2.24882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine. The TPSA of 72.99 Ų falls within the moderate polarity range, balancing permeability and solubility for N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine. Following Lipinski's Rule of Five, N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-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-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine?
The CAS number of N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine is 94166-54-8.
What is the molecular formula of N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine?
The molecular formula of N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine is C12H14N4O2.
What is the molecular weight of N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine?
The molecular weight of N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine is 246.11 g/mol.
Where can I buy N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine?
You can request a quote for N-((1,5-Dimethyl-1H-pyrrol-2-yl)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-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-((1,5-Dimethyl-1H-pyrrol-2-yl)methyl)-5-nitropyridin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.