1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)-
TL;DR: 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)- (CAS 1238-65-9) is a chemical compound with molecular formula C21H26N2O and molecular weight 322.2045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methyl-2-(2-morpholin-4-ylethyl)-2-naphthalen-1-ylbutanenitrile
Also Known As: alpha-Isopropyl-alpha-(2-morpholinoethyl)-1-naphthaleneacetonitrile, 1-NAPHTHALENEACETONITRILE, alpha-ISOPROPYL-alpha-(2-MORPHOLINOETHYL)-, 3-methyl-2-(2-morpholin-4-ylethyl)-2-naphthalen-1-ylbutanenitrile, 2-isopropyl-4-morpholino-2-(naphthalen-1-yl)butanenitrile, 3-methyl-2-[2-(morpholin-4-yl)ethyl]-2-(naphthalen-1-yl)butanenitrile
Technical Specifications
| Molecular Formula | C21H26N2O |
| Molecular Weight | 322.2045 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.2045 Da |
| Heavy Atoms | 24 |
| Complexity | 448.0 |
| SMILES | CC(C)C(CCN1CCOCC1)(C#N)C2=CC=CC3=CC=CC=C32 |
| InChIKey | OGRZCCCGYFWIDL-UHFFFAOYSA-N |
Chemical Property Profile of 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)-
Property Insights of 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)-
The XLogP value of 4.0 indicates that 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.3 Ų, 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)- 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
What is the CAS number of 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)-?
The CAS number of 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)- is 1238-65-9.
What is the molecular formula of 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)-?
The molecular formula of 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)- is C21H26N2O.
What is the molecular weight of 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)-?
The molecular weight of 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)- is 322.2045 g/mol.
Where can I buy 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)-?
You can request a quote for 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)-?
Yes, CoreyChem provides custom synthesis services for 1-Naphthaleneacetonitrile, alpha-isopropyl-alpha-(2-morpholinoethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.