N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide
TL;DR: N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide (CAS 54385-56-7) is a chemical compound with molecular formula C11H13N5O and molecular weight 231.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4,5-dicyano-2-methylpyrazol-3-yl)-2,2-dimethylpropanamide
Also Known As: N-(4,5-dicyano-2-methylpyrazol-3-yl)-2,2-dimethylpropanamide, N-(4,5-DICYANO-2-METHYL-PYRAZOL-3-YL)-2,2-DIMETHYL-PROPANAMIDE, N-(3,4-Dicyano-1-methyl-1H-pyrazol-5-yl)-2,2-dimethylpropanamide, N-(4,5-dicyano-2-methyl-2H-pyrazol-3-yl)-2,2-dimethyl-propionamide
| Molecular Formula | C11H13N5O |
|---|---|
| Molecular Weight | 231.11 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 94.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.11201 |
| Heavy Atoms | 17 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 54385-56-7 |
|---|---|
| SMILES | CC(C)(C)C(=O)NC1=C(C(=NN1C)C#N)C#N |
| InChIKey | FAPHEUCDPOPFKL-UHFFFAOYSA-N |
Product Overview
N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide (CAS 54385-56-7), with molecular formula C11H13N5O and molecular weight 231.11 g/mol. IUPAC: N-(4,5-dicyano-2-methylpyrazol-3-yl)-2,2-dimethylpropanamide.
Chemical Property Profile of N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide
Property Insights of N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide. Following Lipinski's Rule of Five, N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide has 1 hydrogen bond donor(s) and 4 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 N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide?
The CAS number of N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide is 54385-56-7.
What is the molecular formula of N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide?
The molecular formula of N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide is C11H13N5O.
What is the molecular weight of N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide?
The molecular weight of N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide is 231.11 g/mol.
Where can I buy N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide?
You can request a quote for N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4,5-Dicyano-2-methyl-pyrazol-3-YL)-2,2-dimethyl-propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.