About 4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide
4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide (PubChem CID 79043682) has the molecular formula C14H15N3O
and a molecular weight of 241.29 g/mol. Its IUPAC name is 4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide.
Molecular Properties
| Compound Name | 4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide |
| PubChem CID | 79043682 |
| Molecular Formula | C14H15N3O |
| Molecular Weight | 241.29 g/mol |
| Exact Mass | 241.12 |
| IUPAC Name | 4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide |
| SMILES | CNc1ccc(C(=O)Nc2cccnc2C)cc1 |
| InChI | InChI=1S/C14H15N3O/c1-10-13(4-3-9-16-10)17-14(18)11-5-7-12(15-2)8-6-11/h3-9,15H,1-2H3,(H,17,18) |
| InChIKey | AJQFFGDTXKETQH-UHFFFAOYSA-N |
| XLogP | 2.68 |
| TPSA | 54.02 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 241.29 |
| LogP ≤ 5 | 2.68 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide?
The IUPAC name of 4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide (CID 79043682) is 4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide.
What is the SMILES notation for 4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide?
The canonical SMILES for 4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide is CNc1ccc(C(=O)Nc2cccnc2C)cc1.
What is the InChIKey of 4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide?
The InChIKey is AJQFFGDTXKETQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-10-13(4-3-9-16-10)17-14(18)11-5-7-12(15-2)8-6-11/h3-9,15H,1-2H3,(H,17,18).
What are the key properties of 4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide?
4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide has a molecular weight of 241.29 g/mol, XLogP of 2.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide is sourced from PubChem (CID 79043682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).