5-(Diethylamino)pentanenitrile
TL;DR: 5-(Diethylamino)pentanenitrile (CAS 6066-93-9) is a chemical compound with molecular formula C9H18N2 and molecular weight 154.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(diethylamino)pentanenitrile
Also Known As: 5-(Diethylamino)pentanenitrile, 5-diethylaminovaleronitrile, 5-(diethylamino)valeronitrile, Valeronitrile 5-[diethylamino]-, 5-(Diethylamino)pentanenitrile #
| Molecular Formula | C9H18N2 |
|---|---|
| Molecular Weight | 154.15 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 154.147 |
| Heavy Atoms | 11 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 6066-93-9 |
|---|---|
| SMILES | CCN(CC)CCCCC#N |
| InChIKey | RLHLKRQJVSVNIQ-UHFFFAOYSA-N |
Product Overview
5-(Diethylamino)pentanenitrile (CAS 6066-93-9), with molecular formula C9H18N2 and molecular weight 154.15 g/mol. IUPAC: 5-(diethylamino)pentanenitrile.
Chemical Property Profile of 5-(Diethylamino)pentanenitrile
Property Insights of 5-(Diethylamino)pentanenitrile
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Diethylamino)pentanenitrile. With a topological polar surface area (TPSA) of 27.0 Ų, 5-(Diethylamino)pentanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Diethylamino)pentanenitrile 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 5-(Diethylamino)pentanenitrile?
The CAS number of 5-(Diethylamino)pentanenitrile is 6066-93-9.
What is the molecular formula of 5-(Diethylamino)pentanenitrile?
The molecular formula of 5-(Diethylamino)pentanenitrile is C9H18N2.
What is the molecular weight of 5-(Diethylamino)pentanenitrile?
The molecular weight of 5-(Diethylamino)pentanenitrile is 154.15 g/mol.
Where can I buy 5-(Diethylamino)pentanenitrile?
You can request a quote for 5-(Diethylamino)pentanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Diethylamino)pentanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-(Diethylamino)pentanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.