![1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine structure](/static/products/1426/1426293-57-3.webp)
1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine
TL;DR: 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine (CAS 1426293-57-3) is a chemical compound with molecular formula C13H14N2O3 and molecular weight 246.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(3-nitrophenyl)-1-pyrrolidin-1-ylprop-2-en-1-one
Also Known As: 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine, (E)-3-(3-Nitrophenyl)-1-(pyrrolidin-1-yl)prop-2-en-1-one, (E)-3-(3-nitrophenyl)-1-pyrrolidin-1-ylprop-2-en-1-one, (2E)-3-(3-nitrophenyl)-1-(pyrrolidin-1-yl)prop-2-en-1-one, 1-(2E)-3-(3-Nitrophenyl)prop-2-enoylpyrrolidine
| Molecular Formula | C13H14N2O3 |
|---|---|
| Molecular Weight | 246.10 g/mol |
| LogP | 2.2304 |
| Topological Polar Surface Area | 63.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.10045 |
| Heavy Atoms | 18 |
| Complexity | 490.76465 |
Chemical Identifiers
| CAS Number | 1426293-57-3 |
|---|---|
| SMILES | C1CCN(C1)C(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine (CAS 1426293-57-3), with molecular formula C13H14N2O3 and molecular weight 246.10 g/mol. IUPAC: (E)-3-(3-nitrophenyl)-1-pyrrolidin-1-ylprop-2-en-1-one.
Chemical Property Profile of 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine
Property Insights of 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine
The XLogP value of 2.2304 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine. The TPSA of 63.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine. Following Lipinski's Rule of Five, 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine has 0 hydrogen bond donor(s) and 3 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 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine?
The CAS number of 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine is 1426293-57-3.
What is the molecular formula of 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine?
The molecular formula of 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine is C13H14N2O3.
What is the molecular weight of 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine?
The molecular weight of 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine is 246.10 g/mol.
Where can I buy 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine?
You can request a quote for 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.