5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile
TL;DR: 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile (CAS 3399-36-8) is a chemical compound with molecular formula C20H26N2 and molecular weight 294.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(dimethylamino)-2-naphthalen-1-yl-2-propan-2-ylpentanenitrile
Also Known As: CIS-1,4-DIMETHYL CYCLOHEXANEDICARBOXYLATE, alpha-(3-(Dimethylamino)propyl)-alpha-isopropyl-1-naphthaleneacetonitrile, 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile, 5-(dimethylamino)-2-naphthalen-1-yl-2-propan-2-ylpentanenitrile, 1-NAPHTHALENEACETONITRILE, alpha-(3-(DIMETHYLAMINO)PROPYL)-alpha-ISOPROPYL-
| Molecular Formula | C20H26N2 |
|---|---|
| Molecular Weight | 294.21 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 294.2096 |
| Heavy Atoms | 22 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 3399-36-8 |
|---|---|
| SMILES | CC(C)C(CCCN(C)C)(C#N)C1=CC=CC2=CC=CC=C21 |
| InChIKey | MHHHMEYFZWKUDY-UHFFFAOYSA-N |
Product Overview
5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile (CAS 3399-36-8), with molecular formula C20H26N2 and molecular weight 294.21 g/mol. IUPAC: 5-(dimethylamino)-2-naphthalen-1-yl-2-propan-2-ylpentanenitrile.
Chemical Property Profile of 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile
Property Insights of 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile
The XLogP value of 4.8 indicates that 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.0 Ų, 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)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-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile?
The CAS number of 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile is 3399-36-8.
What is the molecular formula of 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile?
The molecular formula of 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile is C20H26N2.
What is the molecular weight of 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile?
The molecular weight of 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile is 294.21 g/mol.
Where can I buy 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile?
You can request a quote for 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.