4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile
TL;DR: 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile (CAS 397275-42-2) is a chemical compound with molecular formula C15H20N2O and molecular weight 244.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-propan-2-ylpiperidin-4-yl)oxybenzonitrile
Also Known As: 4-[(1-propan-2-yl-4-piperidyl)oxy]benzonitrile, 4-{[1-(propan-2-yl)piperidin-4-yl]oxy}benzonitrile
| Molecular Formula | C15H20N2O |
|---|---|
| Molecular Weight | 244.16 g/mol |
| LogP | 2.80988 |
| Topological Polar Surface Area | 36.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.15756 |
| Heavy Atoms | 18 |
| Complexity | 411.1149 |
Chemical Identifiers
| CAS Number | 397275-42-2 |
|---|---|
| SMILES | CC(C)N1CCC(CC1)OC2=CC=C(C=C2)C#N |
Product Overview
4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile (CAS 397275-42-2), with molecular formula C15H20N2O and molecular weight 244.16 g/mol. IUPAC: 4-(1-propan-2-ylpiperidin-4-yl)oxybenzonitrile.
Chemical Property Profile of 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile
Property Insights of 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile
The XLogP value of 2.80988 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile. With a topological polar surface area (TPSA) of 36.26 Ų, 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile has 0 hydrogen bond donor(s) and 3 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 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile?
The CAS number of 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile is 397275-42-2.
What is the molecular formula of 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile?
The molecular formula of 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile is C15H20N2O.
What is the molecular weight of 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile?
The molecular weight of 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile is 244.16 g/mol.
Where can I buy 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile?
You can request a quote for 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(1-Propan-2-ylpiperidin-4-yl)oxybenzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.