About 3-(aminomethyl)-N-methylpyridin-2-amine
3-(aminomethyl)-N-methylpyridin-2-amine (PubChem CID 14518301) has the molecular formula C7H11N3
and a molecular weight of 137.19 g/mol. Its IUPAC name is 3-(aminomethyl)-N-methylpyridin-2-amine.
Molecular Properties
| Compound Name | 3-(aminomethyl)-N-methylpyridin-2-amine |
| PubChem CID | 14518301 |
| Molecular Formula | C7H11N3 |
| Molecular Weight | 137.19 g/mol |
| Exact Mass | 137.10 |
| IUPAC Name | 3-(aminomethyl)-N-methylpyridin-2-amine |
| SMILES | CNc1ncccc1CN |
| InChI | InChI=1S/C7H11N3/c1-9-7-6(5-8)3-2-4-10-7/h2-4H,5,8H2,1H3,(H,9,10) |
| InChIKey | IGYVKGUNRCIJDC-UHFFFAOYSA-N |
| XLogP | 0.58 |
| TPSA | 50.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 137.19 |
| LogP ≤ 5 | 0.58 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 3-(aminomethyl)-N-methylpyridin-2-amine?
The IUPAC name of 3-(aminomethyl)-N-methylpyridin-2-amine (CID 14518301) is 3-(aminomethyl)-N-methylpyridin-2-amine.
What is the SMILES notation for 3-(aminomethyl)-N-methylpyridin-2-amine?
The canonical SMILES for 3-(aminomethyl)-N-methylpyridin-2-amine is CNc1ncccc1CN.
What is the InChIKey of 3-(aminomethyl)-N-methylpyridin-2-amine?
The InChIKey is IGYVKGUNRCIJDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3/c1-9-7-6(5-8)3-2-4-10-7/h2-4H,5,8H2,1H3,(H,9,10).
What are the key properties of 3-(aminomethyl)-N-methylpyridin-2-amine?
3-(aminomethyl)-N-methylpyridin-2-amine has a molecular weight of 137.19 g/mol, XLogP of 0.58, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-methylpyridin-2-amine is sourced from PubChem (CID 14518301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).