6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide

C17H14F3N5OS — CID 11524022

About 6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide

6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide (PubChem CID 11524022) has the molecular formula C17H14F3N5OS and a molecular weight of 393.39 g/mol. Its IUPAC name is 6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide
• PubChem CID: 11524022
• Molecular Formula: C17H14F3N5OS
• Molecular Weight: 393.39 g/mol
• Exact Mass: 393.09
• IUPAC Name: 6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide
• SMILES: Cc1ccc(Nc2ccc(C)nc2C(=O)Nc2nc(C(F)(F)F)cs2)cn1
• InChI: InChI=1S/C17H14F3N5OS/c1-9-3-5-11(7-21-9)23-12-6-4-10(2)22-14(12)15(26)25-16-24-13(8-27-16)17(18,19)20/h3-8,23H,1-2H3,(H,24,25,26)
• InChIKey: ZLCFQPIVNJVQCN-UHFFFAOYSA-N
• XLogP: 4.56
• TPSA: 79.80 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	393.39
LogP ≤ 5	4.56
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide?

The IUPAC name of 6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide (CID 11524022) is 6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide.

What is the SMILES notation for 6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide?

The canonical SMILES for 6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide is Cc1ccc(Nc2ccc(C)nc2C(=O)Nc2nc(C(F)(F)F)cs2)cn1.

What is the InChIKey of 6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide?

The InChIKey is ZLCFQPIVNJVQCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14F3N5OS/c1-9-3-5-11(7-21-9)23-12-6-4-10(2)22-14(12)15(26)25-16-24-13(8-27-16)17(18,19)20/h3-8,23H,1-2H3,(H,24,25,26).

What are the key properties of 6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide?

6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide has a molecular weight of 393.39 g/mol, XLogP of 4.56, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 6-methyl-3-[(6-methyl-3-pyridinyl)amino]-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide is sourced from PubChem (CID 11524022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).