About 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine
2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine (PubChem CID 43721974) has the molecular formula C11H14N4O
and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine.
Molecular Properties
| Compound Name | 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine |
| PubChem CID | 43721974 |
| Molecular Formula | C11H14N4O |
| Molecular Weight | 218.26 g/mol |
| Exact Mass | 218.12 |
| IUPAC Name | 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine |
| SMILES | COc1ncccc1NCc1ccnn1C |
| InChI | InChI=1S/C11H14N4O/c1-15-9(5-7-14-15)8-13-10-4-3-6-12-11(10)16-2/h3-7,13H,8H2,1-2H3 |
| InChIKey | PNKBJTXFKUECPN-UHFFFAOYSA-N |
| XLogP | 1.44 |
| TPSA | 51.97 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 218.26 |
| LogP ≤ 5 | 1.44 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine?
The IUPAC name of 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine (CID 43721974) is 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine.
What is the SMILES notation for 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine?
The canonical SMILES for 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine is COc1ncccc1NCc1ccnn1C.
What is the InChIKey of 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine?
The InChIKey is PNKBJTXFKUECPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-15-9(5-7-14-15)8-13-10-4-3-6-12-11(10)16-2/h3-7,13H,8H2,1-2H3.
What are the key properties of 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine?
2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine has a molecular weight of 218.26 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine is sourced from PubChem (CID 43721974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).