About 2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide
2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide (PubChem CID 62640761) has the molecular formula C16H14N4O
and a molecular weight of 278.32 g/mol. Its IUPAC name is 2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide.
Molecular Properties
| Compound Name | 2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide |
| PubChem CID | 62640761 |
| Molecular Formula | C16H14N4O |
| Molecular Weight | 278.32 g/mol |
| Exact Mass | 278.12 |
| IUPAC Name | 2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide |
| SMILES | CNc1cc(C(=O)Nc2ccc3ncccc3c2)ccn1 |
| InChI | InChI=1S/C16H14N4O/c1-17-15-10-12(6-8-19-15)16(21)20-13-4-5-14-11(9-13)3-2-7-18-14/h2-10H,1H3,(H,17,19)(H,20,21) |
| InChIKey | FJIKPEMESZLAHJ-UHFFFAOYSA-N |
| XLogP | 2.92 |
| TPSA | 66.91 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 278.32 |
| LogP ≤ 5 | 2.92 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide?
The IUPAC name of 2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide (CID 62640761) is 2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide.
What is the SMILES notation for 2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide?
The canonical SMILES for 2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide is CNc1cc(C(=O)Nc2ccc3ncccc3c2)ccn1.
What is the InChIKey of 2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide?
The InChIKey is FJIKPEMESZLAHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O/c1-17-15-10-12(6-8-19-15)16(21)20-13-4-5-14-11(9-13)3-2-7-18-14/h2-10H,1H3,(H,17,19)(H,20,21).
What are the key properties of 2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide?
2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide has a molecular weight of 278.32 g/mol, XLogP of 2.92, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide is sourced from PubChem (CID 62640761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).