About 2-methyl-N'-(9-oxofluorene-2-carbonyl)imidazo[1,2-a]pyridine-3-carbohydrazide
2-methyl-N'-(9-oxofluorene-2-carbonyl)imidazo[1,2-a]pyridine-3-carbohydrazide (PubChem CID 24619999) has the molecular formula C23H16N4O3
and a molecular weight of 396.41 g/mol. Its IUPAC name is 2-methyl-N'-(9-oxofluorene-2-carbonyl)imidazo[1,2-a]pyridine-3-carbohydrazide.
Molecular Properties
| Compound Name | 2-methyl-N'-(9-oxofluorene-2-carbonyl)imidazo[1,2-a]pyridine-3-carbohydrazide |
| PubChem CID | 24619999 |
| Molecular Formula | C23H16N4O3 |
| Molecular Weight | 396.41 g/mol |
| Exact Mass | 396.12 |
| IUPAC Name | 2-methyl-N'-(9-oxofluorene-2-carbonyl)imidazo[1,2-a]pyridine-3-carbohydrazide |
| SMILES | Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc2c(c1)C(=O)c1ccccc1-2 |
| InChI | InChI=1S/C23H16N4O3/c1-13-20(27-11-5-4-8-19(27)24-13)23(30)26-25-22(29)14-9-10-16-15-6-2-3-7-17(15)21(28)18(16)12-14/h2-12H,1H3,(H,25,29)(H,26,30) |
| InChIKey | WYCRDQHBAOMEHR-UHFFFAOYSA-N |
| XLogP | 2.93 |
| TPSA | 92.57 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 30 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 396.41 |
| LogP ≤ 5 | 2.93 |
| 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 2-methyl-N'-(9-oxofluorene-2-carbonyl)imidazo[1,2-a]pyridine-3-carbohydrazide?
The IUPAC name of 2-methyl-N'-(9-oxofluorene-2-carbonyl)imidazo[1,2-a]pyridine-3-carbohydrazide (CID 24619999) is 2-methyl-N'-(9-oxofluorene-2-carbonyl)imidazo[1,2-a]pyridine-3-carbohydrazide.
What is the SMILES notation for 2-methyl-N'-(9-oxofluorene-2-carbonyl)imidazo[1,2-a]pyridine-3-carbohydrazide?
The canonical SMILES for 2-methyl-N'-(9-oxofluorene-2-carbonyl)imidazo[1,2-a]pyridine-3-carbohydrazide is Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc2c(c1)C(=O)c1ccccc1-2.
What is the InChIKey of 2-methyl-N'-(9-oxofluorene-2-carbonyl)imidazo[1,2-a]pyridine-3-carbohydrazide?
The InChIKey is WYCRDQHBAOMEHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N4O3/c1-13-20(27-11-5-4-8-19(27)24-13)23(30)26-25-22(29)14-9-10-16-15-6-2-3-7-17(15)21(28)18(16)12-14/h2-12H,1H3,(H,25,29)(H,26,30).
What are the key properties of 2-methyl-N'-(9-oxofluorene-2-carbonyl)imidazo[1,2-a]pyridine-3-carbohydrazide?
2-methyl-N'-(9-oxofluorene-2-carbonyl)imidazo[1,2-a]pyridine-3-carbohydrazide has a molecular weight of 396.41 g/mol, XLogP of 2.93, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N'-(9-oxofluorene-2-carbonyl)imidazo[1,2-a]pyridine-3-carbohydrazide is sourced from PubChem (CID 24619999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).