1-(3-Nitropyridin-2-yl)piperidin-4-one
TL;DR: 1-(3-Nitropyridin-2-yl)piperidin-4-one (CAS 338411-72-6) is a chemical compound with molecular formula C10H11N3O3 and molecular weight 221.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-nitro-2-pyridinyl)piperidin-4-one
Also Known As: 1-(3-nitropyridin-2-yl)piperidin-4-one, 1-(3-nitro-2-pyridinyl)tetrahydro-4(1H)-pyridinone, nitropyridinyltetrahydropyridinone, 1-(3-nitro-2-pyridyl)piperidin-4-one, 1-(3-nitro-2-pyridyl)-4-oxopiperidine
| Molecular Formula | C10H11N3O3 |
|---|---|
| Molecular Weight | 221.08 g/mol |
| LogP | 1.1591 |
| Topological Polar Surface Area | 76.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.08005 |
| Heavy Atoms | 16 |
| Complexity | 423.07236 |
Chemical Identifiers
| CAS Number | 338411-72-6 |
|---|---|
| SMILES | C1CN(CCC1=O)C2=C(C=CC=N2)[N+](=O)[O-] |
Product Overview
1-(3-Nitropyridin-2-yl)piperidin-4-one (CAS 338411-72-6), with molecular formula C10H11N3O3 and molecular weight 221.08 g/mol. IUPAC: 1-(3-nitro-2-pyridinyl)piperidin-4-one.
Chemical Property Profile of 1-(3-Nitropyridin-2-yl)piperidin-4-one
Property Insights of 1-(3-Nitropyridin-2-yl)piperidin-4-one
The XLogP value of 1.1591 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Nitropyridin-2-yl)piperidin-4-one. The TPSA of 76.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Nitropyridin-2-yl)piperidin-4-one. Following Lipinski's Rule of Five, 1-(3-Nitropyridin-2-yl)piperidin-4-one has 0 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 1-(3-Nitropyridin-2-yl)piperidin-4-one?
The CAS number of 1-(3-Nitropyridin-2-yl)piperidin-4-one is 338411-72-6.
What is the molecular formula of 1-(3-Nitropyridin-2-yl)piperidin-4-one?
The molecular formula of 1-(3-Nitropyridin-2-yl)piperidin-4-one is C10H11N3O3.
What is the molecular weight of 1-(3-Nitropyridin-2-yl)piperidin-4-one?
The molecular weight of 1-(3-Nitropyridin-2-yl)piperidin-4-one is 221.08 g/mol.
Where can I buy 1-(3-Nitropyridin-2-yl)piperidin-4-one?
You can request a quote for 1-(3-Nitropyridin-2-yl)piperidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Nitropyridin-2-yl)piperidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Nitropyridin-2-yl)piperidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.