3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide

C19H16N8O2 — CID 138589380

About 3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide

3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide (PubChem CID 138589380) has the molecular formula C19H16N8O2 and a molecular weight of 388.39 g/mol. Its IUPAC name is 3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide.

Molecular Properties

• Compound Name: 3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide
• PubChem CID: 138589380
• Molecular Formula: C19H16N8O2
• Molecular Weight: 388.39 g/mol
• Exact Mass: 388.14
• IUPAC Name: 3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide
• SMILES: Cc1cc(C(=O)Nc2cc3cc(-c4cn(C)nn4)ncc3cn2)cnc1C(N)=O
• InChI: InChI=1S/C19H16N8O2/c1-10-3-12(6-23-17(10)18(20)28)19(29)24-16-5-11-4-14(15-9-27(2)26-25-15)21-7-13(11)8-22-16/h3-9H,1-2H3,(H2,20,28)(H,22,24,29)
• InChIKey: YGJDKHJTXMPDHL-UHFFFAOYSA-N
• XLogP: 1.48
• TPSA: 141.57 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 8
• Rotatable Bonds: 4
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	388.39
LogP ≤ 5	1.48
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide?

The IUPAC name of 3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide (CID 138589380) is 3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide.

What is the SMILES notation for 3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide?

The canonical SMILES for 3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide is Cc1cc(C(=O)Nc2cc3cc(-c4cn(C)nn4)ncc3cn2)cnc1C(N)=O.

What is the InChIKey of 3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide?

The InChIKey is YGJDKHJTXMPDHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N8O2/c1-10-3-12(6-23-17(10)18(20)28)19(29)24-16-5-11-4-14(15-9-27(2)26-25-15)21-7-13(11)8-22-16/h3-9H,1-2H3,(H2,20,28)(H,22,24,29).

What are the key properties of 3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide?

3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide has a molecular weight of 388.39 g/mol, XLogP of 1.48, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 3-methyl-5-N-[6-(1-methyltriazol-4-yl)-2,7-naphthyridin-3-yl]pyridine-2,5-dicarboxamide is sourced from PubChem (CID 138589380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).