1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)-
TL;DR: 1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)- (CAS 2572-75-0) is a chemical compound with molecular formula C18H20N2O and molecular weight 280.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-morpholin-4-yl-2-naphthalen-1-ylbutanenitrile
Also Known As: 1-naphthaleneacetonitrile,alpha-, alpha-(2-Morpholinoethyl)-1-naphthaleneacetonitrile, 1-NAPHTHALENEACETONITRILE,alpha- -, 1-NAPHTHALENEACETONITRILE, alpha-(2-MORPHOLINOETHYL)-, alpha-(1-Naphthyl)-4-morpholinebutyronitrile
| Molecular Formula | C18H20N2O |
|---|---|
| Molecular Weight | 280.16 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.15756 |
| Heavy Atoms | 21 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 2572-75-0 |
|---|---|
| SMILES | C1COCCN1CCC(C#N)C2=CC=CC3=CC=CC=C32 |
| InChIKey | WHKRMZWZYJGMCN-UHFFFAOYSA-N |
Product Overview
1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)- (CAS 2572-75-0), with molecular formula C18H20N2O and molecular weight 280.16 g/mol. IUPAC: 4-morpholin-4-yl-2-naphthalen-1-ylbutanenitrile.
Chemical Property Profile of 1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)-
Property Insights of 1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)-. With a topological polar surface area (TPSA) of 36.3 Ų, 1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Naphthaleneacetonitrile, 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
Frequently Asked Questions
What is the CAS number of 1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)-?
The CAS number of 1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)- is 2572-75-0.
What is the molecular formula of 1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)-?
The molecular formula of 1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)- is C18H20N2O.
What is the molecular weight of 1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)-?
The molecular weight of 1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)- is 280.16 g/mol.
Where can I buy 1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)-?
You can request a quote for 1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)- 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-(2-morpholinoethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Naphthaleneacetonitrile, alpha-(2-morpholinoethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.