![2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile structure](/static/products/902/90207-20-8.png)
2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile
TL;DR: 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile (CAS 90207-20-8) is a chemical compound with molecular formula C18H28N2 and molecular weight 272.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile
Also Known As: 2-[2-(diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile, 2-(2-diethylaminoethyl)-3-methyl-2-phenylpentanenitrile, 2-(2-(DIETHYLAMINO)-ETHYL)-3-METHYL-2-PHENYLVALERONITRILE
| Molecular Formula | C18H28N2 |
|---|---|
| Molecular Weight | 272.23 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 272.22525 |
| Heavy Atoms | 20 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 90207-20-8 |
|---|---|
| SMILES | CCC(C)C(CCN(CC)CC)(C#N)C1=CC=CC=C1 |
| InChIKey | WQQPLWOAYDTFGS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile (CAS 90207-20-8), with molecular formula C18H28N2 and molecular weight 272.23 g/mol. IUPAC: 2-[2-(diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile.
Chemical Property Profile of 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile
Property Insights of 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile
The XLogP value of 4.4 indicates that 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.0 Ų, 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile 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 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile?
The CAS number of 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile is 90207-20-8.
What is the molecular formula of 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile?
The molecular formula of 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile is C18H28N2.
What is the molecular weight of 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile?
The molecular weight of 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile is 272.23 g/mol.
Where can I buy 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile?
You can request a quote for 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(Diethylamino)ethyl]-3-methyl-2-phenylpentanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.