About 4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine
4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine (PubChem CID 63329318) has the molecular formula C12H13N3
and a molecular weight of 199.26 g/mol. Its IUPAC name is 4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine.
Molecular Properties
| Compound Name | 4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine |
| PubChem CID | 63329318 |
| Molecular Formula | C12H13N3 |
| Molecular Weight | 199.26 g/mol |
| Exact Mass | 199.11 |
| IUPAC Name | 4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine |
| SMILES | Cc1ccncc1NCc1ccccn1 |
| InChI | InChI=1S/C12H13N3/c1-10-5-7-13-9-12(10)15-8-11-4-2-3-6-14-11/h2-7,9,15H,8H2,1H3 |
| InChIKey | WXIJRYGGRQJGRO-UHFFFAOYSA-N |
| XLogP | 2.40 |
| TPSA | 37.81 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 199.26 |
| LogP ≤ 5 | 2.40 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine?
The IUPAC name of 4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine (CID 63329318) is 4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine.
What is the SMILES notation for 4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine?
The canonical SMILES for 4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine is Cc1ccncc1NCc1ccccn1.
What is the InChIKey of 4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine?
The InChIKey is WXIJRYGGRQJGRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c1-10-5-7-13-9-12(10)15-8-11-4-2-3-6-14-11/h2-7,9,15H,8H2,1H3.
What are the key properties of 4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine?
4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine has a molecular weight of 199.26 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine is sourced from PubChem (CID 63329318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).