1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl-
TL;DR: 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl- (CAS 6699-18-9) is a chemical compound with molecular formula C22H30N2 and molecular weight 322.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(diethylamino)-2-naphthalen-1-yl-2-propan-2-ylpentanenitrile
Also Known As: alpha-(3-(Diethylamino)propyl)-alpha-isopropyl-1-naphthaleneacetonitrile, 1-NAPHTHALENEACETONITRILE, alpha-(3-(DIETHYLAMINO)PROPYL)-alpha-ISOPROPYL-, 5-(Diethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile, 5-(diethylamino)-2-naphthalen-1-yl-2-propan-2-ylpentanenitrile, 1-Naphthaleneacetonitrile, .alpha.-[3-(diethylamino)propyl]-.alpha.-(1-methylethyl)-
| Molecular Formula | C22H30N2 |
|---|---|
| Molecular Weight | 322.24 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 322.2409 |
| Heavy Atoms | 24 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 6699-18-9 |
|---|---|
| SMILES | CCN(CC)CCCC(C#N)(C1=CC=CC2=CC=CC=C21)C(C)C |
| InChIKey | MJRCSPPJFWJOQU-UHFFFAOYSA-N |
Product Overview
1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl- (CAS 6699-18-9), with molecular formula C22H30N2 and molecular weight 322.24 g/mol. IUPAC: 5-(diethylamino)-2-naphthalen-1-yl-2-propan-2-ylpentanenitrile.
Chemical Property Profile of 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl-
Property Insights of 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl-
The XLogP value of 5.5 indicates that 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.0 Ų, 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl-?
The CAS number of 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl- is 6699-18-9.
What is the molecular formula of 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl-?
The molecular formula of 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl- is C22H30N2.
What is the molecular weight of 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl-?
The molecular weight of 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl- is 322.24 g/mol.
Where can I buy 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl-?
You can request a quote for 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl-?
Yes, KEHONG BIO provides custom synthesis services for 1-Naphthaleneacetonitrile, alpha-(3-(diethylamino)propyl)-alpha-isopropyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.