octahydro-1H-pyrido[1,2-a]piperazin-1-one
TL;DR: octahydro-1H-pyrido[1,2-a]piperazin-1-one (CAS 22328-80-9) is a chemical compound with molecular formula C8H14N2O and molecular weight 154.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-1-one
Also Known As: octahydro-1H-pyrido[1,2-a]piperazin-1-one, Octahydro-1H-pyrido[1,2-a]pyrazin-1-one, 1,4-Diazabicyclo(4.4.0)decane-5-one, Hexahydro-2H-pyrido(1,2-a)pyrazin-1(6H)-one, Hexahydro-pyrido[1,2-a]pyrazin-1-one
| Molecular Formula | C8H14N2O |
|---|---|
| Molecular Weight | 154.11 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 154.11061 |
| Heavy Atoms | 11 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 22328-80-9 |
|---|---|
| SMILES | C1CCN2CCNC(=O)C2C1 |
| InChIKey | AGBUHYGWJRLISC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
octahydro-1H-pyrido[1,2-a]piperazin-1-one (CAS 22328-80-9), with molecular formula C8H14N2O and molecular weight 154.11 g/mol. IUPAC: 2,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-1-one.
Chemical Property Profile of octahydro-1H-pyrido[1,2-a]piperazin-1-one
Property Insights of octahydro-1H-pyrido[1,2-a]piperazin-1-one
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for octahydro-1H-pyrido[1,2-a]piperazin-1-one. With a topological polar surface area (TPSA) of 32.3 Ų, octahydro-1H-pyrido[1,2-a]piperazin-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, octahydro-1H-pyrido[1,2-a]piperazin-1-one has 1 hydrogen bond donor(s) and 2 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 octahydro-1H-pyrido[1,2-a]piperazin-1-one?
The CAS number of octahydro-1H-pyrido[1,2-a]piperazin-1-one is 22328-80-9.
What is the molecular formula of octahydro-1H-pyrido[1,2-a]piperazin-1-one?
The molecular formula of octahydro-1H-pyrido[1,2-a]piperazin-1-one is C8H14N2O.
What is the molecular weight of octahydro-1H-pyrido[1,2-a]piperazin-1-one?
The molecular weight of octahydro-1H-pyrido[1,2-a]piperazin-1-one is 154.11 g/mol.
Where can I buy octahydro-1H-pyrido[1,2-a]piperazin-1-one?
You can request a quote for octahydro-1H-pyrido[1,2-a]piperazin-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for octahydro-1H-pyrido[1,2-a]piperazin-1-one?
Yes, KEHONG BIO provides custom synthesis services for octahydro-1H-pyrido[1,2-a]piperazin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.