About N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine
N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine (PubChem CID 19626584) has the molecular formula C11H14N4
and a molecular weight of 202.26 g/mol. Its IUPAC name is N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine.
Molecular Properties
| Compound Name | N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine |
| PubChem CID | 19626584 |
| Molecular Formula | C11H14N4 |
| Molecular Weight | 202.26 g/mol |
| Exact Mass | 202.12 |
| IUPAC Name | N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine |
| SMILES | Cn1nccc1CNCc1cccnc1 |
| InChI | InChI=1S/C11H14N4/c1-15-11(4-6-14-15)9-13-8-10-3-2-5-12-7-10/h2-7,13H,8-9H2,1H3 |
| InChIKey | JAMGJWYCMDQFNT-UHFFFAOYSA-N |
| XLogP | 1.10 |
| TPSA | 42.74 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 202.26 |
| LogP ≤ 5 | 1.10 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine?
The IUPAC name of N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine (CID 19626584) is N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine.
What is the SMILES notation for N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine?
The canonical SMILES for N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine is Cn1nccc1CNCc1cccnc1.
What is the InChIKey of N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine?
The InChIKey is JAMGJWYCMDQFNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4/c1-15-11(4-6-14-15)9-13-8-10-3-2-5-12-7-10/h2-7,13H,8-9H2,1H3.
What are the key properties of N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine?
N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine has a molecular weight of 202.26 g/mol, XLogP of 1.10, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine is sourced from PubChem (CID 19626584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).