![1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro- structure](/static/products/778/77821-80-8.png)
1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro-
TL;DR: 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro- (CAS 77821-80-8) is a chemical compound with molecular formula C11H12N2O and molecular weight 188.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethyl-2-oxo-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carbonitrile
Also Known As: A2881/0121441, 3-Cyano-4-ethyl-2-oxo-2,5,6,7-tetrahydro-1H-1-pyrindine, 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro-, 4-ethyl-2-oxo-1,5,6,7-tetrahydrocyclopenta[2,1-b]pyridine-3-carbonitrile, 4-ethyl-2-oxo-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carbonitrile
| Molecular Formula | C11H12N2O |
|---|---|
| Molecular Weight | 188.09 g/mol |
| LogP | 1.29768 |
| Topological Polar Surface Area | 56.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.09496 |
| Heavy Atoms | 14 |
| Complexity | 465.4015 |
Chemical Identifiers
| CAS Number | 77821-80-8 |
|---|---|
| SMILES | CCC1=C(C(=O)NC2=C1CCC2)C#N |
Product Overview
1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro- (CAS 77821-80-8), with molecular formula C11H12N2O and molecular weight 188.09 g/mol. IUPAC: 4-ethyl-2-oxo-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carbonitrile.
Chemical Property Profile of 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro-
Property Insights of 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro-
The XLogP value of 1.29768 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro-. With a topological polar surface area (TPSA) of 56.65 Ų, 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro- 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 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro-?
The CAS number of 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro- is 77821-80-8.
What is the molecular formula of 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro-?
The molecular formula of 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro- is C11H12N2O.
What is the molecular weight of 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro-?
The molecular weight of 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro- is 188.09 g/mol.
Where can I buy 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro-?
You can request a quote for 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro-?
Yes, KEHONG BIO provides custom synthesis services for 1H-[1]Pyrindine-3-carbonitrile, 4-ethyl-2-oxo-2,5,6,7-tetrahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.