About 6-(aminomethyl)-N-methyl-N-propan-2-ylpyridine-2-carboxamide
6-(aminomethyl)-N-methyl-N-propan-2-ylpyridine-2-carboxamide (PubChem CID 82507390) has the molecular formula C11H17N3O
and a molecular weight of 207.28 g/mol. Its IUPAC name is 6-(aminomethyl)-N-methyl-N-propan-2-ylpyridine-2-carboxamide.
Molecular Properties
| Compound Name | 6-(aminomethyl)-N-methyl-N-propan-2-ylpyridine-2-carboxamide |
| PubChem CID | 82507390 |
| Molecular Formula | C11H17N3O |
| Molecular Weight | 207.28 g/mol |
| Exact Mass | 207.14 |
| IUPAC Name | 6-(aminomethyl)-N-methyl-N-propan-2-ylpyridine-2-carboxamide |
| SMILES | CC(C)N(C)C(=O)c1cccc(CN)n1 |
| InChI | InChI=1S/C11H17N3O/c1-8(2)14(3)11(15)10-6-4-5-9(7-12)13-10/h4-6,8H,7,12H2,1-3H3 |
| InChIKey | GGVQNCSDTYDEBA-UHFFFAOYSA-N |
| XLogP | 1.02 |
| TPSA | 59.22 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 | 207.28 |
| LogP ≤ 5 | 1.02 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 6-(aminomethyl)-N-methyl-N-propan-2-ylpyridine-2-carboxamide?
The IUPAC name of 6-(aminomethyl)-N-methyl-N-propan-2-ylpyridine-2-carboxamide (CID 82507390) is 6-(aminomethyl)-N-methyl-N-propan-2-ylpyridine-2-carboxamide.
What is the SMILES notation for 6-(aminomethyl)-N-methyl-N-propan-2-ylpyridine-2-carboxamide?
The canonical SMILES for 6-(aminomethyl)-N-methyl-N-propan-2-ylpyridine-2-carboxamide is CC(C)N(C)C(=O)c1cccc(CN)n1.
What is the InChIKey of 6-(aminomethyl)-N-methyl-N-propan-2-ylpyridine-2-carboxamide?
The InChIKey is GGVQNCSDTYDEBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-8(2)14(3)11(15)10-6-4-5-9(7-12)13-10/h4-6,8H,7,12H2,1-3H3.
What are the key properties of 6-(aminomethyl)-N-methyl-N-propan-2-ylpyridine-2-carboxamide?
6-(aminomethyl)-N-methyl-N-propan-2-ylpyridine-2-carboxamide has a molecular weight of 207.28 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-methyl-N-propan-2-ylpyridine-2-carboxamide is sourced from PubChem (CID 82507390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).