About 4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol
4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol (PubChem CID 81107552) has the molecular formula C14H24N4O
and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol.
Molecular Properties
| Compound Name | 4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol |
| PubChem CID | 81107552 |
| Molecular Formula | C14H24N4O |
| Molecular Weight | 264.37 g/mol |
| Exact Mass | 264.20 |
| IUPAC Name | 4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol |
| SMILES | CNc1cc(N2CCC(C)(O)CC2)nc(C(C)C)n1 |
| InChI | InChI=1S/C14H24N4O/c1-10(2)13-16-11(15-4)9-12(17-13)18-7-5-14(3,19)6-8-18/h9-10,19H,5-8H2,1-4H3,(H,15,16,17) |
| InChIKey | FIIWSWQRMOCOKO-UHFFFAOYSA-N |
| XLogP | 1.99 |
| TPSA | 61.28 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 264.37 |
| LogP ≤ 5 | 1.99 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol?
The IUPAC name of 4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol (CID 81107552) is 4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol.
What is the SMILES notation for 4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol?
The canonical SMILES for 4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol is CNc1cc(N2CCC(C)(O)CC2)nc(C(C)C)n1.
What is the InChIKey of 4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol?
The InChIKey is FIIWSWQRMOCOKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-10(2)13-16-11(15-4)9-12(17-13)18-7-5-14(3,19)6-8-18/h9-10,19H,5-8H2,1-4H3,(H,15,16,17).
What are the key properties of 4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol?
4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol has a molecular weight of 264.37 g/mol, XLogP of 1.99, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol is sourced from PubChem (CID 81107552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).