N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole

C66H57F6N15O6S6 — CID 162034988

About N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole

N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole (PubChem CID 162034988) has the molecular formula C66H57F6N15O6S6 and a molecular weight of 1462.67 g/mol. Its IUPAC name is N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole.

Molecular Properties

• Compound Name: N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole
• PubChem CID: 162034988
• Molecular Formula: C66H57F6N15O6S6
• Molecular Weight: 1462.67 g/mol
• Exact Mass: 1461.28
• IUPAC Name: N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole
• SMILES: COC(=O)c1ccc(-c2nc(C)cs2)cn1.Cc1csc(-c2ccc(C(=O)O)nc2)n1.Cc1csc(-c2ccc(C(F)(F)F)nc2)n1.Cc1csc(-c2ccc(N(C)C)nc2)n1.Cc1csc(-c2ccc(OC(F)(F)F)nc2)n1.Cc1ncco1.[C-]#[N+]c1ccc(-c2nc(C)cs2)cn1
• InChI: InChI=1S/C11H13N3S.C11H10N2O2S.C10H7F3N2OS.C10H7F3N2S.C10H7N3S.C10H8N2O2S.C4H5NO/c1-8-7-15-11(13-8)9-4-5-10(12-6-9)14(2)3;1-7-6-16-10(13-7)8-3-4-9(12-5-8)11(14)15-2;1-6-5-17-9(15-6)7-2-3-8(14-4-7)16-10(11,12)13;1-6-5-16-9(15-6)7-2-3-8(14-4-7)10(11,12)13;1-7-6-14-10(13-7)8-3-4-9(11-2)12-5-8;1-6-5-15-9(12-6)7-2-3-8(10(13)14)11-4-7;1-4-5-2-3-6-4/h4-7H,1-3H3;3-6H,1-2H3;2-5H,1H3;2-5H,1H3;3-6H,1H3;2-5H,1H3,(H,13,14);2-3H,1H3
• InChIKey: YWNKUTDSRTZDRM-UHFFFAOYSA-N
• XLogP: 18.08
• TPSA: 261.14 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 25
• Rotatable Bonds: 10
• Heavy Atoms: 99
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1462.67
LogP ≤ 5	18.08
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole?

The IUPAC name of N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole (CID 162034988) is N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole.

What is the SMILES notation for N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole?

The canonical SMILES for N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole is COC(=O)c1ccc(-c2nc(C)cs2)cn1.Cc1csc(-c2ccc(C(=O)O)nc2)n1.Cc1csc(-c2ccc(C(F)(F)F)nc2)n1.Cc1csc(-c2ccc(N(C)C)nc2)n1.Cc1csc(-c2ccc(OC(F)(F)F)nc2)n1.Cc1ncco1.[C-]#[N+]c1ccc(-c2nc(C)cs2)cn1.

What is the InChIKey of N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole?

The InChIKey is YWNKUTDSRTZDRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3S.C11H10N2O2S.C10H7F3N2OS.C10H7F3N2S.C10H7N3S.C10H8N2O2S.C4H5NO/c1-8-7-15-11(13-8)9-4-5-10(12-6-9)14(2)3;1-7-6-16-10(13-7)8-3-4-9(12-5-8)11(14)15-2;1-6-5-17-9(15-6)7-2-3-8(14-4-7)16-10(11,12)13;1-6-5-16-9(15-6)7-2-3-8(14-4-7)10(11,12)13;1-7-6-14-10(13-7)8-3-4-9(11-2)12-5-8;1-6-5-15-9(12-6)7-2-3-8(10(13)14)11-4-7;1-4-5-2-3-6-4/h4-7H,1-3H3;3-6H,1-2H3;2-5H,1H3;2-5H,1H3;3-6H,1H3;2-5H,1H3,(H,13,14);2-3H,1H3.

What are the key properties of N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole?

N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole has a molecular weight of 1462.67 g/mol, XLogP of 18.08, 10 rotatable bonds, 1 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)pyridin-2-amine;2-(6-isocyano-3-pyridinyl)-4-methyl-1,3-thiazole;methyl 5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylate;2-methyl-1,3-oxazole;5-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxylic acid;4-methyl-2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazole;4-methyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole is sourced from PubChem (CID 162034988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).