About [5-(phenylmethoxymethyl)pyrazin-2-yl]hydrazine
[5-(phenylmethoxymethyl)pyrazin-2-yl]hydrazine (PubChem CID 103061763) has the molecular formula C12H14N4O
and a molecular weight of 230.27 g/mol. Its IUPAC name is [5-(phenylmethoxymethyl)pyrazin-2-yl]hydrazine.
Molecular Properties
| Compound Name | [5-(phenylmethoxymethyl)pyrazin-2-yl]hydrazine |
| PubChem CID | 103061763 |
| Molecular Formula | C12H14N4O |
| Molecular Weight | 230.27 g/mol |
| Exact Mass | 230.12 |
| IUPAC Name | [5-(phenylmethoxymethyl)pyrazin-2-yl]hydrazine |
| SMILES | NNc1cnc(COCc2ccccc2)cn1 |
| InChI | InChI=1S/C12H14N4O/c13-16-12-7-14-11(6-15-12)9-17-8-10-4-2-1-3-5-10/h1-7H,8-9,13H2,(H,15,16) |
| InChIKey | XQSNMUSTHDYNHB-UHFFFAOYSA-N |
| XLogP | 1.48 |
| TPSA | 73.06 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 230.27 |
| LogP ≤ 5 | 1.48 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [5-(phenylmethoxymethyl)pyrazin-2-yl]hydrazine?
The IUPAC name of [5-(phenylmethoxymethyl)pyrazin-2-yl]hydrazine (CID 103061763) is [5-(phenylmethoxymethyl)pyrazin-2-yl]hydrazine.
What is the SMILES notation for [5-(phenylmethoxymethyl)pyrazin-2-yl]hydrazine?
The canonical SMILES for [5-(phenylmethoxymethyl)pyrazin-2-yl]hydrazine is NNc1cnc(COCc2ccccc2)cn1.
What is the InChIKey of [5-(phenylmethoxymethyl)pyrazin-2-yl]hydrazine?
The InChIKey is XQSNMUSTHDYNHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c13-16-12-7-14-11(6-15-12)9-17-8-10-4-2-1-3-5-10/h1-7H,8-9,13H2,(H,15,16).
What are the key properties of [5-(phenylmethoxymethyl)pyrazin-2-yl]hydrazine?
[5-(phenylmethoxymethyl)pyrazin-2-yl]hydrazine has a molecular weight of 230.27 g/mol, XLogP of 1.48, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(phenylmethoxymethyl)pyrazin-2-yl]hydrazine is sourced from PubChem (CID 103061763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).