About (5-methyl-3-pyridinyl)-quinolin-4-ylmethanamine
(5-methyl-3-pyridinyl)-quinolin-4-ylmethanamine (PubChem CID 105173960) has the molecular formula C16H15N3
and a molecular weight of 249.32 g/mol. Its IUPAC name is (5-methyl-3-pyridinyl)-quinolin-4-ylmethanamine.
Molecular Properties
| Compound Name | (5-methyl-3-pyridinyl)-quinolin-4-ylmethanamine |
| PubChem CID | 105173960 |
| Molecular Formula | C16H15N3 |
| Molecular Weight | 249.32 g/mol |
| Exact Mass | 249.13 |
| IUPAC Name | (5-methyl-3-pyridinyl)-quinolin-4-ylmethanamine |
| SMILES | Cc1cncc(C(N)c2ccnc3ccccc23)c1 |
| InChI | InChI=1S/C16H15N3/c1-11-8-12(10-18-9-11)16(17)14-6-7-19-15-5-3-2-4-13(14)15/h2-10,16H,17H2,1H3 |
| InChIKey | ZBDWIDNCMCXADK-UHFFFAOYSA-N |
| XLogP | 2.99 |
| TPSA | 51.80 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 249.32 |
| LogP ≤ 5 | 2.99 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of (5-methyl-3-pyridinyl)-quinolin-4-ylmethanamine?
The IUPAC name of (5-methyl-3-pyridinyl)-quinolin-4-ylmethanamine (CID 105173960) is (5-methyl-3-pyridinyl)-quinolin-4-ylmethanamine.
What is the SMILES notation for (5-methyl-3-pyridinyl)-quinolin-4-ylmethanamine?
The canonical SMILES for (5-methyl-3-pyridinyl)-quinolin-4-ylmethanamine is Cc1cncc(C(N)c2ccnc3ccccc23)c1.
What is the InChIKey of (5-methyl-3-pyridinyl)-quinolin-4-ylmethanamine?
The InChIKey is ZBDWIDNCMCXADK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3/c1-11-8-12(10-18-9-11)16(17)14-6-7-19-15-5-3-2-4-13(14)15/h2-10,16H,17H2,1H3.
What are the key properties of (5-methyl-3-pyridinyl)-quinolin-4-ylmethanamine?
(5-methyl-3-pyridinyl)-quinolin-4-ylmethanamine has a molecular weight of 249.32 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-3-pyridinyl)-quinolin-4-ylmethanamine is sourced from PubChem (CID 105173960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).