2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten

C80H96Br2Cl4N13O15W- — CID 158127666

About 2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten

2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten (PubChem CID 158127666) has the molecular formula C80H96Br2Cl4N13O15W- and a molecular weight of 1965.18 g/mol. Its IUPAC name is 2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten.

Molecular Properties

• Compound Name: 2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten
• PubChem CID: 158127666
• Molecular Formula: C80H96Br2Cl4N13O15W-
• Molecular Weight: 1965.18 g/mol
• Exact Mass: 1960.38
• IUPAC Name: 2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten
• SMILES: COc1ccc(Cl)c(Br)n1.COc1ccc(Cl)c(N(C(=O)c2ccc(C3=NOC(C)(C)C3=O)cc2)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)n1.COc1ccc(Cl)c(N(C(=O)c2ccc(C3=NOC(C)(C)C3=O)cc2)[C@@H]2CCCNC2)n1.COc1ccc(Cl)c(N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)n1.COc1cccc(Br)n1.[CH3-].[W]
• InChI: InChI=1S/C28H33ClN4O6.C23H25ClN4O4.C16H24ClN3O3.C6H5BrClNO.C6H6BrNO.CH3.W/c1-27(2,3)38-26(36)32-15-7-8-19(16-32)33(24-20(29)13-14-21(30-24)37-6)25(35)18-11-9-17(10-12-18)22-23(34)28(4,5)39-31-22;1-23(2)20(29)19(27-32-23)14-6-8-15(9-7-14)22(30)28(16-5-4-12-25-13-16)21-17(24)10-11-18(26-21)31-3;1-16(2,3)23-15(21)20-9-5-6-11(10-20)18-14-12(17)7-8-13(19-14)22-4;1-10-5-3-2-4(8)6(7)9-5;1-9-6-4-2-3-5(7)8-6;;/h9-14,19H,7-8,15-16H2,1-6H3;6-11,16,25H,4-5,12-13H2,1-3H3;7-8,11H,5-6,9-10H2,1-4H3,(H,18,19);2-3H,1H3;2-4H,1H3;1H3;/q;;;;;-1;/t19-;16-;11-;;;;/m111..../s1
• InChIKey: HHRQMZNYXMZCLI-FIYDWHBLSA-N
• XLogP: 16.46
• TPSA: 311.68 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 24
• Rotatable Bonds: 15
• Heavy Atoms: 115
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1965.18
LogP ≤ 5	16.46
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten?

The IUPAC name of 2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten (CID 158127666) is 2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten.

What is the SMILES notation for 2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten?

The canonical SMILES for 2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten is COc1ccc(Cl)c(Br)n1.COc1ccc(Cl)c(N(C(=O)c2ccc(C3=NOC(C)(C)C3=O)cc2)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)n1.COc1ccc(Cl)c(N(C(=O)c2ccc(C3=NOC(C)(C)C3=O)cc2)[C@@H]2CCCNC2)n1.COc1ccc(Cl)c(N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)n1.COc1cccc(Br)n1.[CH3-].[W].

What is the InChIKey of 2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten?

The InChIKey is HHRQMZNYXMZCLI-FIYDWHBLSA-N. The full InChI is InChI=1S/C28H33ClN4O6.C23H25ClN4O4.C16H24ClN3O3.C6H5BrClNO.C6H6BrNO.CH3.W/c1-27(2,3)38-26(36)32-15-7-8-19(16-32)33(24-20(29)13-14-21(30-24)37-6)25(35)18-11-9-17(10-12-18)22-23(34)28(4,5)39-31-22;1-23(2)20(29)19(27-32-23)14-6-8-15(9-7-14)22(30)28(16-5-4-12-25-13-16)21-17(24)10-11-18(26-21)31-3;1-16(2,3)23-15(21)20-9-5-6-11(10-20)18-14-12(17)7-8-13(19-14)22-4;1-10-5-3-2-4(8)6(7)9-5;1-9-6-4-2-3-5(7)8-6;;/h9-14,19H,7-8,15-16H2,1-6H3;6-11,16,25H,4-5,12-13H2,1-3H3;7-8,11H,5-6,9-10H2,1-4H3,(H,18,19);2-3H,1H3;2-4H,1H3;1H3;/q;;;;;-1;/t19-;16-;11-;;;;/m111..../s1.

What are the key properties of 2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten?

2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten has a molecular weight of 1965.18 g/mol, XLogP of 16.46, 15 rotatable bonds, 2 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 2-bromo-3-chloro-6-methoxypyridine;2-bromo-6-methoxypyridine;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(3-chloro-6-methoxy-2-pyridinyl)-[4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)benzoyl]amino]piperidine-1-carboxylate;carbanide;N-(3-chloro-6-methoxy-2-pyridinyl)-4-(5,5-dimethyl-4-oxo-1,2-oxazol-3-yl)-N-[(3R)-piperidin-3-yl]benzamide;tungsten is sourced from PubChem (CID 158127666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).