About [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol
[4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol (PubChem CID 166243495) has the molecular formula C10H15FN4O
and a molecular weight of 226.25 g/mol. Its IUPAC name is [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol.
Molecular Properties
| Compound Name | [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol |
| PubChem CID | 166243495 |
| Molecular Formula | C10H15FN4O |
| Molecular Weight | 226.25 g/mol |
| Exact Mass | 226.12 |
| IUPAC Name | [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol |
| SMILES | NC1(CO)CCN(c2cnc(F)cn2)CC1 |
| InChI | InChI=1S/C10H15FN4O/c11-8-5-14-9(6-13-8)15-3-1-10(12,7-16)2-4-15/h5-6,16H,1-4,7,12H2 |
| InChIKey | PAIUZZURRRWJJD-UHFFFAOYSA-N |
| XLogP | -0.09 |
| TPSA | 75.27 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 226.25 |
| LogP ≤ 5 | -0.09 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol?
The IUPAC name of [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol (CID 166243495) is [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol.
What is the SMILES notation for [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol?
The canonical SMILES for [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol is NC1(CO)CCN(c2cnc(F)cn2)CC1.
What is the InChIKey of [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol?
The InChIKey is PAIUZZURRRWJJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN4O/c11-8-5-14-9(6-13-8)15-3-1-10(12,7-16)2-4-15/h5-6,16H,1-4,7,12H2.
What are the key properties of [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol?
[4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol has a molecular weight of 226.25 g/mol, XLogP of -0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol is sourced from PubChem (CID 166243495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).