1-(3-Pyridinylcarbonyl)piperazine
TL;DR: 1-(3-Pyridinylcarbonyl)piperazine (CAS 39947-94-9) is a chemical compound with molecular formula C10H13N3O and molecular weight 191.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
piperazin-1-yl(pyridin-3-yl)methanone
Also Known As: piperazin-1-yl(pyridin-3-yl)methanone, Piperazin-1-yl-pyridin-3-yl-methanone, 1-(pyridine-3-carbonyl)piperazine, 1-(pyridin-3-ylcarbonyl)piperazine, 1-piperazinyl(3-pyridinyl)methanone
| Molecular Formula | C10H13N3O |
|---|---|
| Molecular Weight | 191.11 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 45.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.10587 |
| Heavy Atoms | 14 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 39947-94-9 |
|---|---|
| SMILES | C1CN(CCN1)C(=O)C2=CN=CC=C2 |
| InChIKey | VYSFCBZMPSKWOF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(3-Pyridinylcarbonyl)piperazine (CAS 39947-94-9), with molecular formula C10H13N3O and molecular weight 191.11 g/mol. IUPAC: piperazin-1-yl(pyridin-3-yl)methanone.
Chemical Property Profile of 1-(3-Pyridinylcarbonyl)piperazine
Property Insights of 1-(3-Pyridinylcarbonyl)piperazine
The XLogP value of -0.3 indicates that 1-(3-Pyridinylcarbonyl)piperazine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 45.2 Ų, 1-(3-Pyridinylcarbonyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Pyridinylcarbonyl)piperazine has 1 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-(3-Pyridinylcarbonyl)piperazine?
The CAS number of 1-(3-Pyridinylcarbonyl)piperazine is 39947-94-9.
What is the molecular formula of 1-(3-Pyridinylcarbonyl)piperazine?
The molecular formula of 1-(3-Pyridinylcarbonyl)piperazine is C10H13N3O.
What is the molecular weight of 1-(3-Pyridinylcarbonyl)piperazine?
The molecular weight of 1-(3-Pyridinylcarbonyl)piperazine is 191.11 g/mol.
Where can I buy 1-(3-Pyridinylcarbonyl)piperazine?
You can request a quote for 1-(3-Pyridinylcarbonyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Pyridinylcarbonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Pyridinylcarbonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.