2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline
TL;DR: 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline (CAS 432522-96-8) is a chemical compound with molecular formula C15H21N3O3 and molecular weight 291.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline
Also Known As: AB00120506-01, 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline, (2-nitro-5-pyrrolidinylphenyl)(oxolan-2-ylmethyl)amine, A3045/0128565, 2-nitro-5-(pyrrolidin-1-yl)-N-(tetrahydrofuran-2-ylmethyl)aniline
| Molecular Formula | C15H21N3O3 |
|---|---|
| Molecular Weight | 291.16 g/mol |
| LogP | 2.7859 |
| Topological Polar Surface Area | 67.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 291.1583 |
| Heavy Atoms | 21 |
| Complexity | 508.88535 |
Chemical Identifiers
| CAS Number | 432522-96-8 |
|---|---|
| SMILES | C1CCN(C1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3CCCO3 |
Product Overview
2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline (CAS 432522-96-8), with molecular formula C15H21N3O3 and molecular weight 291.16 g/mol. IUPAC: 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline.
Chemical Property Profile of 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline
Property Insights of 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline
The XLogP value of 2.7859 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline. The TPSA of 67.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline. Following Lipinski's Rule of Five, 2-nitro-N-(oxolan-2-ylmethyl)-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 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline?
The CAS number of 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline is 432522-96-8.
What is the molecular formula of 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline?
The molecular formula of 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline is C15H21N3O3.
What is the molecular weight of 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline?
The molecular weight of 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline is 291.16 g/mol.
Where can I buy 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline?
You can request a quote for 2-nitro-N-(oxolan-2-ylmethyl)-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 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline?
Yes, KEHONG BIO provides custom synthesis services for 2-nitro-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.