1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone
TL;DR: 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone (CAS 116248-10-3) is a chemical compound with molecular formula C9H11N3O and molecular weight 177.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-pyrimidin-2-ylpiperidin-4-one
Also Known As: 1-Pyrimidin-2-yl-piperidin-4-one, 1-(pyrimidin-2-yl)piperidin-4-one, 1-pyrimidin-2-ylpiperidin-4-one, 4-Piperidinone, 1-(2-pyrimidinyl)-, 1-(2-PYRIMIDINYL)TETRAHYDRO-4(1H)-PYRIDINONE
| Molecular Formula | C9H11N3O |
|---|---|
| Molecular Weight | 177.09 g/mol |
| LogP | 0.6459 |
| Topological Polar Surface Area | 46.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.09021 |
| Heavy Atoms | 13 |
| Complexity | 288.98795 |
Chemical Identifiers
| CAS Number | 116248-10-3 |
|---|---|
| SMILES | C1CN(CCC1=O)C2=NC=CC=N2 |
Product Overview
1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone (CAS 116248-10-3), with molecular formula C9H11N3O and molecular weight 177.09 g/mol. IUPAC: 1-pyrimidin-2-ylpiperidin-4-one.
Chemical Property Profile of 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone
Property Insights of 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone
The XLogP value of 0.6459 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone. With a topological polar surface area (TPSA) of 46.09 Ų, 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone has 0 hydrogen bond donor(s) and 4 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-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone?
The CAS number of 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone is 116248-10-3.
What is the molecular formula of 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone?
The molecular formula of 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone is C9H11N3O.
What is the molecular weight of 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone?
The molecular weight of 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone is 177.09 g/mol.
Where can I buy 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone?
You can request a quote for 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.