About 1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine
1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine (PubChem CID 105262150) has the molecular formula C10H13N3
and a molecular weight of 175.23 g/mol. Its IUPAC name is 1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine.
Molecular Properties
| Compound Name | 1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine |
| PubChem CID | 105262150 |
| Molecular Formula | C10H13N3 |
| Molecular Weight | 175.23 g/mol |
| Exact Mass | 175.11 |
| IUPAC Name | 1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine |
| SMILES | C#CC(NN)c1ccncc1CC |
| InChI | InChI=1S/C10H13N3/c1-3-8-7-12-6-5-9(8)10(4-2)13-11/h2,5-7,10,13H,3,11H2,1H3 |
| InChIKey | FPWXGCGPUWYITH-UHFFFAOYSA-N |
| XLogP | 0.78 |
| TPSA | 50.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 175.23 |
| LogP ≤ 5 | 0.78 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine?
The IUPAC name of 1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine (CID 105262150) is 1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine.
What is the SMILES notation for 1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine?
The canonical SMILES for 1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine is C#CC(NN)c1ccncc1CC.
What is the InChIKey of 1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine?
The InChIKey is FPWXGCGPUWYITH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c1-3-8-7-12-6-5-9(8)10(4-2)13-11/h2,5-7,10,13H,3,11H2,1H3.
What are the key properties of 1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine?
1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine has a molecular weight of 175.23 g/mol, XLogP of 0.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine is sourced from PubChem (CID 105262150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).