About N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide
N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide (PubChem CID 90509364) has the molecular formula C14H15N3O2
and a molecular weight of 257.29 g/mol. Its IUPAC name is N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide.
Molecular Properties
| Compound Name | N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide |
| PubChem CID | 90509364 |
| Molecular Formula | C14H15N3O2 |
| Molecular Weight | 257.29 g/mol |
| Exact Mass | 257.12 |
| IUPAC Name | N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide |
| SMILES | CCN(C(=O)c1ccc(OC)nn1)c1ccccc1 |
| InChI | InChI=1S/C14H15N3O2/c1-3-17(11-7-5-4-6-8-11)14(18)12-9-10-13(19-2)16-15-12/h4-10H,3H2,1-2H3 |
| InChIKey | HPAAHPNXZFAEJN-UHFFFAOYSA-N |
| XLogP | 2.15 |
| TPSA | 55.32 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 257.29 |
| LogP ≤ 5 | 2.15 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide?
The IUPAC name of N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide (CID 90509364) is N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide.
What is the SMILES notation for N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide?
The canonical SMILES for N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide is CCN(C(=O)c1ccc(OC)nn1)c1ccccc1.
What is the InChIKey of N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide?
The InChIKey is HPAAHPNXZFAEJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-3-17(11-7-5-4-6-8-11)14(18)12-9-10-13(19-2)16-15-12/h4-10H,3H2,1-2H3.
What are the key properties of N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide?
N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 2.15, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide is sourced from PubChem (CID 90509364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).