(2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One
TL;DR: (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One (CAS 66521-53-7) is a chemical compound with molecular formula C10H12N2O and molecular weight 176.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(dimethylamino)-1-pyridin-4-ylprop-2-en-1-one
Also Known As: (E)-3-(dimethylamino)-1-(pyridin-4-yl)prop-2-en-1-one, 3-(dimethylamino)-1-(pyridin-4-yl)prop-2-en-1-one, 2-Propen-1-one, 3-(dimethylamino)-1-(4-pyridinyl)-, (2E)-, (E)-3-Dimethylamino-1-pyridin-4-yl-propenone, (E)-3-(dimethylamino)-1-pyridin-4-ylprop-2-en-1-one
| Molecular Formula | C10H12N2O |
|---|---|
| Molecular Weight | 176.09 g/mol |
| LogP | 1.3396 |
| Topological Polar Surface Area | 33.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 176.09496 |
| Heavy Atoms | 13 |
| Complexity | 303.9606 |
Chemical Identifiers
| CAS Number | 66521-53-7 |
|---|---|
| SMILES | CN(C)/C=C/C(=O)C1=CC=NC=C1 |
Product Overview
(2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One (CAS 66521-53-7), with molecular formula C10H12N2O and molecular weight 176.09 g/mol. IUPAC: (E)-3-(dimethylamino)-1-pyridin-4-ylprop-2-en-1-one.
Chemical Property Profile of (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One
Property Insights of (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One
The XLogP value of 1.3396 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One. With a topological polar surface area (TPSA) of 33.2 Ų, (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One 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 (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One?
The CAS number of (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One is 66521-53-7.
What is the molecular formula of (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One?
The molecular formula of (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One is C10H12N2O.
What is the molecular weight of (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One?
The molecular weight of (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One is 176.09 g/mol.
Where can I buy (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One?
You can request a quote for (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-(Dimethylamino)-1-(4-Pyridinyl)-2-Propen-1-One and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.