2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)-
TL;DR: 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)- (CAS 69914-13-2) is a chemical compound with molecular formula C11H11NO2 and molecular weight 189.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-oxocyclohexen-1-yl)pyridin-2-one
Also Known As: 1-(3-oxocyclohexen-1-yl)pyridin-2-one, 1-(3-oxo-cyclohex-1-enyl)-1h-pyridin-2-one, 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)-, methyl 1,3-dimethyl-1H-indol-2-carboxylate, 1-(3-oxocyclohex-1-enyl)pyridin-2(1H)-one
| Molecular Formula | C11H11NO2 |
|---|---|
| Molecular Weight | 189.08 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.07898 |
| Heavy Atoms | 14 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 69914-13-2 |
|---|---|
| SMILES | C1CC(=CC(=O)C1)N2C=CC=CC2=O |
| InChIKey | LFJSNFZWPSTKGH-UHFFFAOYSA-N |
Product Overview
2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)- (CAS 69914-13-2), with molecular formula C11H11NO2 and molecular weight 189.08 g/mol. IUPAC: 1-(3-oxocyclohexen-1-yl)pyridin-2-one.
Chemical Property Profile of 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)-
Property Insights of 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)-. With a topological polar surface area (TPSA) of 37.4 Ų, 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)- has 0 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 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)-?
The CAS number of 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)- is 69914-13-2.
What is the molecular formula of 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)-?
The molecular formula of 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)- is C11H11NO2.
What is the molecular weight of 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)-?
The molecular weight of 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)- is 189.08 g/mol.
Where can I buy 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)-?
You can request a quote for 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)-?
Yes, KEHONG BIO provides custom synthesis services for 2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.