N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline
TL;DR: N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline (CAS 347355-90-2) is a chemical compound with molecular formula C15H17N3O3 and molecular weight 287.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline
Also Known As: (2-furylmethyl)(2-nitro-5-pyrrolidinylphenyl)amine, N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline, 2-(2-nitro-5-pyrrolidin-1-ylanilinomethyl)furan, N-(furan-2-ylmethyl)-2-nitro-5-(pyrrolidin-1-yl)aniline, Furan-2-ylmethyl-(2-nitro-5-pyrrolidin-1-yl-phenyl)-amine
| Molecular Formula | C15H17N3O3 |
|---|---|
| Molecular Weight | 287.13 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 74.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 287.12698 |
| Heavy Atoms | 21 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 347355-90-2 |
|---|---|
| SMILES | C1CCN(C1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CO3 |
| InChIKey | XKALFWXLPPPRIT-UHFFFAOYSA-N |
Product Overview
N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline (CAS 347355-90-2), with molecular formula C15H17N3O3 and molecular weight 287.13 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline.
Chemical Property Profile of N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline
Property Insights of N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline
The XLogP value of 3.5 indicates that N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline. Following Lipinski's Rule of Five, N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline has 1 hydrogen bond donor(s) and 5 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-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline?
The CAS number of N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline is 347355-90-2.
What is the molecular formula of N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline?
The molecular formula of N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline is C15H17N3O3.
What is the molecular weight of N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline?
The molecular weight of N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline is 287.13 g/mol.
Where can I buy N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline?
You can request a quote for N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(furan-2-ylmethyl)-2-nitro-5-pyrrolidin-1-ylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.