1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one
TL;DR: 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one (CAS 19364-68-2) is a chemical compound with molecular formula C6H10N2O and molecular weight 126.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-5-methyl-4H-pyrazol-3-one
Also Known As: 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one, 1-ethyl-3-methyl-1H-pyrazol-5(4H)-one, 2-ethyl-5-methyl-4H-pyrazol-3-one, 3H-Pyrazol-3-one, 2-ethyl-2,4-dihydro-5-methyl-, 1-ethyl-3-methyl-2-pyrazolin-5-one
| Molecular Formula | C6H10N2O |
|---|---|
| Molecular Weight | 126.08 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 126.079315 |
| Heavy Atoms | 9 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 19364-68-2 |
|---|---|
| SMILES | CCN1C(=O)CC(=N1)C |
| InChIKey | BDKWKEPROQIWCA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one (CAS 19364-68-2), with molecular formula C6H10N2O and molecular weight 126.08 g/mol. IUPAC: 2-ethyl-5-methyl-4H-pyrazol-3-one.
Chemical Property Profile of 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one
Property Insights of 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one. With a topological polar surface area (TPSA) of 32.7 Ų, 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one has 0 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 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one?
The CAS number of 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one is 19364-68-2.
What is the molecular formula of 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one?
The molecular formula of 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one is C6H10N2O.
What is the molecular weight of 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one?
The molecular weight of 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one is 126.08 g/mol.
Where can I buy 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one?
You can request a quote for 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one?
Yes, KEHONG BIO provides custom synthesis services for 1-ethyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.