About N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine
N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 133490145) has the molecular formula C17H20N4O2
and a molecular weight of 312.37 g/mol. Its IUPAC name is N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine.
Molecular Properties
| Compound Name | N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine |
| PubChem CID | 133490145 |
| Molecular Formula | C17H20N4O2 |
| Molecular Weight | 312.37 g/mol |
| Exact Mass | 312.16 |
| IUPAC Name | N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine |
| SMILES | COc1ccccc1OCCN(C)c1nccn2nc(C)cc12 |
| InChI | InChI=1S/C17H20N4O2/c1-13-12-14-17(18-8-9-21(14)19-13)20(2)10-11-23-16-7-5-4-6-15(16)22-3/h4-9,12H,10-11H2,1-3H3 |
| InChIKey | FMXKHSVOZQIFOB-UHFFFAOYSA-N |
| XLogP | 2.56 |
| TPSA | 51.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 312.37 |
| LogP ≤ 5 | 2.56 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |
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Frequently Asked Questions
What is the IUPAC name of N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine (CID 133490145) is N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine is COc1ccccc1OCCN(C)c1nccn2nc(C)cc12.
What is the InChIKey of N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is FMXKHSVOZQIFOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2/c1-13-12-14-17(18-8-9-21(14)19-13)20(2)10-11-23-16-7-5-4-6-15(16)22-3/h4-9,12H,10-11H2,1-3H3.
What are the key properties of N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine?
N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 312.37 g/mol, XLogP of 2.56, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 133490145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).