About 5-pyridin-2-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide
5-pyridin-2-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide (PubChem CID 6733993) has the molecular formula C15H11N3O2S2
and a molecular weight of 329.41 g/mol. Its IUPAC name is 5-pyridin-2-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide.
Molecular Properties
| Compound Name | 5-pyridin-2-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide |
| PubChem CID | 6733993 |
| Molecular Formula | C15H11N3O2S2 |
| Molecular Weight | 329.41 g/mol |
| Exact Mass | 329.03 |
| IUPAC Name | 5-pyridin-2-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide |
| SMILES | O=C(NNC(=O)c1ccc(-c2ccccn2)s1)c1cccs1 |
| InChI | InChI=1S/C15H11N3O2S2/c19-14(12-5-3-9-21-12)17-18-15(20)13-7-6-11(22-13)10-4-1-2-8-16-10/h1-9H,(H,17,19)(H,18,20) |
| InChIKey | RNAYNXXNOUFRPH-UHFFFAOYSA-N |
| XLogP | 2.95 |
| TPSA | 71.09 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 329.41 |
| LogP ≤ 5 | 2.95 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 5-pyridin-2-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide?
The IUPAC name of 5-pyridin-2-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide (CID 6733993) is 5-pyridin-2-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide.
What is the SMILES notation for 5-pyridin-2-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide?
The canonical SMILES for 5-pyridin-2-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide is O=C(NNC(=O)c1ccc(-c2ccccn2)s1)c1cccs1.
What is the InChIKey of 5-pyridin-2-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide?
The InChIKey is RNAYNXXNOUFRPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O2S2/c19-14(12-5-3-9-21-12)17-18-15(20)13-7-6-11(22-13)10-4-1-2-8-16-10/h1-9H,(H,17,19)(H,18,20).
What are the key properties of 5-pyridin-2-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide?
5-pyridin-2-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide has a molecular weight of 329.41 g/mol, XLogP of 2.95, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-2-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide is sourced from PubChem (CID 6733993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).