About [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine
[2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine (PubChem CID 105221137) has the molecular formula C10H11ClN4S
and a molecular weight of 254.75 g/mol. Its IUPAC name is [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine.
Molecular Properties
| Compound Name | [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine |
| PubChem CID | 105221137 |
| Molecular Formula | C10H11ClN4S |
| Molecular Weight | 254.75 g/mol |
| Exact Mass | 254.04 |
| IUPAC Name | [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine |
| SMILES | NNC(Cc1ccc(Cl)s1)c1ccncn1 |
| InChI | InChI=1S/C10H11ClN4S/c11-10-2-1-7(16-10)5-9(15-12)8-3-4-13-6-14-8/h1-4,6,9,15H,5,12H2 |
| InChIKey | MFDISJLFSKKDHZ-UHFFFAOYSA-N |
| XLogP | 1.94 |
| TPSA | 63.83 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 254.75 |
| LogP ≤ 5 | 1.94 |
| 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 [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine?
The IUPAC name of [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine (CID 105221137) is [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine.
What is the SMILES notation for [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine?
The canonical SMILES for [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine is NNC(Cc1ccc(Cl)s1)c1ccncn1.
What is the InChIKey of [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine?
The InChIKey is MFDISJLFSKKDHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4S/c11-10-2-1-7(16-10)5-9(15-12)8-3-4-13-6-14-8/h1-4,6,9,15H,5,12H2.
What are the key properties of [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine?
[2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine has a molecular weight of 254.75 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine is sourced from PubChem (CID 105221137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).