3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one
TL;DR: 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one (CAS 90778-25-9) is a chemical compound with molecular formula C6H5F3N2O and molecular weight 178.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-5-(trifluoromethyl)-1H-pyridin-2-one
Also Known As: 3-Amino-5-(trifluoromethyl)pyridin-2-ol, 3-Amino-2-hydroxy-5-trifluoromethylpyridine, 3-amino-5-(trifluoromethyl)pyridin-2(1H)-one, 3-Amino-2-hydroxy-5-(trifluoromethyl)pyridine, 3-amino-5-(trifluoromethyl)-1H-pyridin-2-one
| Molecular Formula | C6H5F3N2O |
|---|---|
| Molecular Weight | 178.04 g/mol |
| LogP | 0.9759 |
| Topological Polar Surface Area | 58.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 178.0354 |
| Heavy Atoms | 12 |
| Complexity | 341.3818 |
Chemical Identifiers
| CAS Number | 90778-25-9 |
|---|---|
| SMILES | C1=C(C(=O)NC=C1C(F)(F)F)N |
Product Overview
3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one (CAS 90778-25-9), with molecular formula C6H5F3N2O and molecular weight 178.04 g/mol. IUPAC: 3-amino-5-(trifluoromethyl)-1H-pyridin-2-one.
Chemical Property Profile of 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one
Property Insights of 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one
The XLogP value of 0.9759 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one. With a topological polar surface area (TPSA) of 58.88 Ų, 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one has 2 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 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one?
The CAS number of 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one is 90778-25-9.
What is the molecular formula of 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one?
The molecular formula of 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one is C6H5F3N2O.
What is the molecular weight of 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one?
The molecular weight of 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one is 178.04 g/mol.
Where can I buy 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one?
You can request a quote for 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.