2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline
TL;DR: 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline (CAS 347355-84-4) is a chemical compound with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-4-nitro-5-pyrrolidin-1-ylaniline
Also Known As: 2-methyl-4-nitro-5-(pyrrolidin-1-yl)aniline, (2-methyl-4-nitro-5-pyrrolidin-1-ylphenyl)amine, 2-methyl-4-nitro-5-pyrrolidin-1-ylaniline, 2-Methyl-4-nitro-5-pyrrolidin-1-yl-phenylamine, CHEMBRDG-BB 6563181
| Molecular Formula | C11H15N3O2 |
|---|---|
| Molecular Weight | 221.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 75.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.11642 |
| Heavy Atoms | 16 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 347355-84-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1N)N2CCCC2)[N+](=O)[O-] |
| InChIKey | FEBLWQMPDLWAAM-UHFFFAOYSA-N |
Product Overview
2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline (CAS 347355-84-4), with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol. IUPAC: 2-methyl-4-nitro-5-pyrrolidin-1-ylaniline.
Chemical Property Profile of 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline
Property Insights of 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline. The TPSA of 75.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline. Following Lipinski's Rule of Five, 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline 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 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline?
The CAS number of 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline is 347355-84-4.
What is the molecular formula of 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline?
The molecular formula of 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline is C11H15N3O2.
What is the molecular weight of 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline?
The molecular weight of 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline is 221.12 g/mol.
Where can I buy 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline?
You can request a quote for 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-4-nitro-5-(pyrrolidin-1-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.