![2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile structure](/static/products/1164/1164476-48-5.webp)
2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile
TL;DR: 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile (CAS 1164476-48-5) is a chemical compound with molecular formula C14H13FN4 and molecular weight 256.11243 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1-(dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile
Also Known As: 2-[1-(dimethylamino)-3-(4-fluoroanilino)-2-propenylidene]malononitrile, 2-[1-(dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile
Technical Specifications
| Molecular Formula | C14H13FN4 |
| Molecular Weight | 256.11243 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 62.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 256.11243 Da |
| Heavy Atoms | 19 |
| Complexity | 434.0 |
| SMILES | CN(C)C(=C(C#N)C#N)C=CNC1=CC=C(C=C1)F |
| InChIKey | DPRSNFCEBROVIO-UHFFFAOYSA-N |
Chemical Property Profile of 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile
Property Insights of 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile. Following Lipinski's Rule of Five, 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile?
The CAS number of 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile is 1164476-48-5.
What is the molecular formula of 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile?
The molecular formula of 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile is C14H13FN4.
What is the molecular weight of 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile?
The molecular weight of 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile is 256.11243 g/mol.
Where can I buy 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile?
You can request a quote for 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile?
Yes, CoreyChem provides custom synthesis services for 2-[1-(Dimethylamino)-3-(4-fluoroanilino)prop-2-enylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.