About N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine
N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine (PubChem CID 43729152) has the molecular formula C8H15N3O
and a molecular weight of 169.23 g/mol. Its IUPAC name is N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine.
Molecular Properties
| Compound Name | N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine |
| PubChem CID | 43729152 |
| Molecular Formula | C8H15N3O |
| Molecular Weight | 169.23 g/mol |
| Exact Mass | 169.12 |
| IUPAC Name | N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine |
| SMILES | CCNc1cnn(CCOC)c1 |
| InChI | InChI=1S/C8H15N3O/c1-3-9-8-6-10-11(7-8)4-5-12-2/h6-7,9H,3-5H2,1-2H3 |
| InChIKey | NLUGNTYXLGWRGC-UHFFFAOYSA-N |
| XLogP | 0.96 |
| TPSA | 39.08 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 169.23 |
| LogP ≤ 5 | 0.96 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine?
The IUPAC name of N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine (CID 43729152) is N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine.
What is the SMILES notation for N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine?
The canonical SMILES for N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine is CCNc1cnn(CCOC)c1.
What is the InChIKey of N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine?
The InChIKey is NLUGNTYXLGWRGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-3-9-8-6-10-11(7-8)4-5-12-2/h6-7,9H,3-5H2,1-2H3.
What are the key properties of N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine?
N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine has a molecular weight of 169.23 g/mol, XLogP of 0.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine is sourced from PubChem (CID 43729152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).