4-Cyanopentylmorpholine
TL;DR: 4-Cyanopentylmorpholine (CAS 84145-72-2) is a chemical compound with molecular formula C9H16N2O and molecular weight 168.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-morpholin-4-ylpentanenitrile
Also Known As: 4-Cyanopentylmorpholine, 4-Morpholinepentanenitrile, 5-Morpholinopentanenitrile, 4-Morpholinevaleronitrile, 5-(morpholin-4-yl)pentanenitrile
| Molecular Formula | C9H16N2O |
|---|---|
| Molecular Weight | 168.13 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.12627 |
| Heavy Atoms | 12 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 84145-72-2 |
|---|---|
| SMILES | C1COCCN1CCCCC#N |
| InChIKey | WTUXHXRBJCBHNP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Cyanopentylmorpholine (CAS 84145-72-2), with molecular formula C9H16N2O and molecular weight 168.13 g/mol. IUPAC: 5-morpholin-4-ylpentanenitrile.
Chemical Property Profile of 4-Cyanopentylmorpholine
Property Insights of 4-Cyanopentylmorpholine
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Cyanopentylmorpholine. With a topological polar surface area (TPSA) of 36.3 Ų, 4-Cyanopentylmorpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Cyanopentylmorpholine 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-Cyanopentylmorpholine?
The CAS number of 4-Cyanopentylmorpholine is 84145-72-2.
What is the molecular formula of 4-Cyanopentylmorpholine?
The molecular formula of 4-Cyanopentylmorpholine is C9H16N2O.
What is the molecular weight of 4-Cyanopentylmorpholine?
The molecular weight of 4-Cyanopentylmorpholine is 168.13 g/mol.
Where can I buy 4-Cyanopentylmorpholine?
You can request a quote for 4-Cyanopentylmorpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Cyanopentylmorpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-Cyanopentylmorpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.