About 1-[1-[2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]-1-methylhydrazine
1-[1-[2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]-1-methylhydrazine (PubChem CID 58919507) has the molecular formula C16H23N5O
and a molecular weight of 301.39 g/mol. Its IUPAC name is 1-[1-[2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]-1-methylhydrazine.
Molecular Properties
| Compound Name | 1-[1-[2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]-1-methylhydrazine |
| PubChem CID | 58919507 |
| Molecular Formula | C16H23N5O |
| Molecular Weight | 301.39 g/mol |
| Exact Mass | 301.19 |
| IUPAC Name | 1-[1-[2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]-1-methylhydrazine |
| SMILES | COc1ccc2nccc(CCN3CCC(N(C)N)C3)c2n1 |
| InChI | InChI=1S/C16H23N5O/c1-20(17)13-7-10-21(11-13)9-6-12-5-8-18-14-3-4-15(22-2)19-16(12)14/h3-5,8,13H,6-7,9-11,17H2,1-2H3 |
| InChIKey | CPODVXKJNODKSH-UHFFFAOYSA-N |
| XLogP | 1.06 |
| TPSA | 67.51 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 301.39 |
| LogP ≤ 5 | 1.06 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 6 |
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 1-[1-[2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]-1-methylhydrazine?
The IUPAC name of 1-[1-[2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]-1-methylhydrazine (CID 58919507) is 1-[1-[2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]-1-methylhydrazine.
What is the SMILES notation for 1-[1-[2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]-1-methylhydrazine?
The canonical SMILES for 1-[1-[2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]-1-methylhydrazine is COc1ccc2nccc(CCN3CCC(N(C)N)C3)c2n1.
What is the InChIKey of 1-[1-[2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]-1-methylhydrazine?
The InChIKey is CPODVXKJNODKSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O/c1-20(17)13-7-10-21(11-13)9-6-12-5-8-18-14-3-4-15(22-2)19-16(12)14/h3-5,8,13H,6-7,9-11,17H2,1-2H3.
What are the key properties of 1-[1-[2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]-1-methylhydrazine?
1-[1-[2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]-1-methylhydrazine has a molecular weight of 301.39 g/mol, XLogP of 1.06, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]-1-methylhydrazine is sourced from PubChem (CID 58919507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).