(2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone
TL;DR: (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone (CAS 83763-19-3) is a chemical compound with molecular formula C15H19NO and molecular weight 229.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl(phenyl)methanone
Also Known As: EINECS 280-702-3, 1-benzoyl-octahydro-1-pyrindine, 1-Benzoyloctahydro-1H-1-pyrindine, (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone, BIM-0013062.P001
| Molecular Formula | C15H19NO |
|---|---|
| Molecular Weight | 229.15 g/mol |
| LogP | 3.0913 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.14667 |
| Heavy Atoms | 17 |
| Complexity | 400.64267 |
Chemical Identifiers
| CAS Number | 83763-19-3 |
|---|---|
| SMILES | C1CC2CCCN(C2C1)C(=O)C3=CC=CC=C3 |
Product Overview
(2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone (CAS 83763-19-3), with molecular formula C15H19NO and molecular weight 229.15 g/mol. IUPAC: 2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl(phenyl)methanone.
Chemical Property Profile of (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone
Property Insights of (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone
The XLogP value of 3.0913 indicates that (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone has 0 hydrogen bond donor(s) and 1 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 (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone?
The CAS number of (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone is 83763-19-3.
What is the molecular formula of (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone?
The molecular formula of (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone is C15H19NO.
What is the molecular weight of (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone?
The molecular weight of (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone is 229.15 g/mol.
Where can I buy (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone?
You can request a quote for (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone?
Yes, KEHONG BIO provides custom synthesis services for (2,3,4,4a,5,6,7,7a-Octahydro-1H-pyridyl) phenyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.