About 4-(4-methylpiperidin-1-yl)-1H-pyrazol-5-amine
4-(4-methylpiperidin-1-yl)-1H-pyrazol-5-amine (PubChem CID 82234552) has the molecular formula C9H16N4
and a molecular weight of 180.25 g/mol. Its IUPAC name is 4-(4-methylpiperidin-1-yl)-1H-pyrazol-5-amine.
Molecular Properties
| Compound Name | 4-(4-methylpiperidin-1-yl)-1H-pyrazol-5-amine |
| PubChem CID | 82234552 |
| Molecular Formula | C9H16N4 |
| Molecular Weight | 180.25 g/mol |
| Exact Mass | 180.14 |
| IUPAC Name | 4-(4-methylpiperidin-1-yl)-1H-pyrazol-5-amine |
| SMILES | CC1CCN(c2cn[nH]c2N)CC1 |
| InChI | InChI=1S/C9H16N4/c1-7-2-4-13(5-3-7)8-6-11-12-9(8)10/h6-7H,2-5H2,1H3,(H3,10,11,12) |
| InChIKey | HUKZSCJWHYYHER-UHFFFAOYSA-N |
| XLogP | 1.23 |
| TPSA | 57.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 180.25 |
| LogP ≤ 5 | 1.23 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-(4-methylpiperidin-1-yl)-1H-pyrazol-5-amine?
The IUPAC name of 4-(4-methylpiperidin-1-yl)-1H-pyrazol-5-amine (CID 82234552) is 4-(4-methylpiperidin-1-yl)-1H-pyrazol-5-amine.
What is the SMILES notation for 4-(4-methylpiperidin-1-yl)-1H-pyrazol-5-amine?
The canonical SMILES for 4-(4-methylpiperidin-1-yl)-1H-pyrazol-5-amine is CC1CCN(c2cn[nH]c2N)CC1.
What is the InChIKey of 4-(4-methylpiperidin-1-yl)-1H-pyrazol-5-amine?
The InChIKey is HUKZSCJWHYYHER-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4/c1-7-2-4-13(5-3-7)8-6-11-12-9(8)10/h6-7H,2-5H2,1H3,(H3,10,11,12).
What are the key properties of 4-(4-methylpiperidin-1-yl)-1H-pyrazol-5-amine?
4-(4-methylpiperidin-1-yl)-1H-pyrazol-5-amine has a molecular weight of 180.25 g/mol, XLogP of 1.23, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylpiperidin-1-yl)-1H-pyrazol-5-amine is sourced from PubChem (CID 82234552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).