About 2-(2-methyltetrazol-5-yl)-2-pyrimidin-5-ylethanol
2-(2-methyltetrazol-5-yl)-2-pyrimidin-5-ylethanol (PubChem CID 170225037) has the molecular formula C8H10N6O
and a molecular weight of 206.21 g/mol. Its IUPAC name is 2-(2-methyltetrazol-5-yl)-2-pyrimidin-5-ylethanol.
Molecular Properties
| Compound Name | 2-(2-methyltetrazol-5-yl)-2-pyrimidin-5-ylethanol |
| PubChem CID | 170225037 |
| Molecular Formula | C8H10N6O |
| Molecular Weight | 206.21 g/mol |
| Exact Mass | 206.09 |
| IUPAC Name | 2-(2-methyltetrazol-5-yl)-2-pyrimidin-5-ylethanol |
| SMILES | Cn1nnc(C(CO)c2cncnc2)n1 |
| InChI | InChI=1S/C8H10N6O/c1-14-12-8(11-13-14)7(4-15)6-2-9-5-10-3-6/h2-3,5,7,15H,4H2,1H3 |
| InChIKey | YWALHFCZABDXTN-UHFFFAOYSA-N |
| XLogP | -0.88 |
| TPSA | 89.61 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 206.21 |
| LogP ≤ 5 | -0.88 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 7 |
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Frequently Asked Questions
What is the IUPAC name of 2-(2-methyltetrazol-5-yl)-2-pyrimidin-5-ylethanol?
The IUPAC name of 2-(2-methyltetrazol-5-yl)-2-pyrimidin-5-ylethanol (CID 170225037) is 2-(2-methyltetrazol-5-yl)-2-pyrimidin-5-ylethanol.
What is the SMILES notation for 2-(2-methyltetrazol-5-yl)-2-pyrimidin-5-ylethanol?
The canonical SMILES for 2-(2-methyltetrazol-5-yl)-2-pyrimidin-5-ylethanol is Cn1nnc(C(CO)c2cncnc2)n1.
What is the InChIKey of 2-(2-methyltetrazol-5-yl)-2-pyrimidin-5-ylethanol?
The InChIKey is YWALHFCZABDXTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N6O/c1-14-12-8(11-13-14)7(4-15)6-2-9-5-10-3-6/h2-3,5,7,15H,4H2,1H3.
What are the key properties of 2-(2-methyltetrazol-5-yl)-2-pyrimidin-5-ylethanol?
2-(2-methyltetrazol-5-yl)-2-pyrimidin-5-ylethanol has a molecular weight of 206.21 g/mol, XLogP of -0.88, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyltetrazol-5-yl)-2-pyrimidin-5-ylethanol is sourced from PubChem (CID 170225037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).