About 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine
1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine (PubChem CID 105114103) has the molecular formula C11H15N5
and a molecular weight of 217.28 g/mol. Its IUPAC name is 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine.
Molecular Properties
| Compound Name | 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine |
| PubChem CID | 105114103 |
| Molecular Formula | C11H15N5 |
| Molecular Weight | 217.28 g/mol |
| Exact Mass | 217.13 |
| IUPAC Name | 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine |
| SMILES | Cc1cnc(C(N)Cc2cnn(C)c2)cn1 |
| InChI | InChI=1S/C11H15N5/c1-8-4-14-11(6-13-8)10(12)3-9-5-15-16(2)7-9/h4-7,10H,3,12H2,1-2H3 |
| InChIKey | MYHFGIRNLZMCEQ-UHFFFAOYSA-N |
| XLogP | 0.76 |
| TPSA | 69.62 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 217.28 |
| LogP ≤ 5 | 0.76 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine?
The IUPAC name of 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine (CID 105114103) is 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine.
What is the SMILES notation for 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine?
The canonical SMILES for 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine is Cc1cnc(C(N)Cc2cnn(C)c2)cn1.
What is the InChIKey of 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine?
The InChIKey is MYHFGIRNLZMCEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-8-4-14-11(6-13-8)10(12)3-9-5-15-16(2)7-9/h4-7,10H,3,12H2,1-2H3.
What are the key properties of 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine?
1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine has a molecular weight of 217.28 g/mol, XLogP of 0.76, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine is sourced from PubChem (CID 105114103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).