7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide

C87H84F2N8O16 — CID 91071156

About 7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide

7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide (PubChem CID 91071156) has the molecular formula C87H84F2N8O16 and a molecular weight of 1535.66 g/mol. Its IUPAC name is 7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide.

Molecular Properties

• Compound Name: 7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide
• PubChem CID: 91071156
• Molecular Formula: C87H84F2N8O16
• Molecular Weight: 1535.66 g/mol
• Exact Mass: 1534.60
• IUPAC Name: 7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide
• SMILES: CC(=O)CNC(=O)C1=C(O)c2cc(-c3ccc(C)nc3F)ccc2C(C)(C)C1=O.CC(=O)CNC(=O)C1=C(O)c2cc(-c3cccnc3C)ccc2C(C)(C)C1=O.CC(=O)CNC(=O)C1=C(O)c2cc(-c3ccnc(C)c3)ccc2C(C)(C)C1=O.CC(=O)CNC(=O)C1=C(O)c2cc(-c3cncc(F)c3)ccc2C(C)(C)C1=O
• InChI: InChI=1S/C22H21FN2O4.2C22H22N2O4.C21H19FN2O4/c1-11-5-7-14(20(23)25-11)13-6-8-16-15(9-13)18(27)17(19(28)22(16,3)4)21(29)24-10-12(2)26;1-12-9-15(7-8-23-12)14-5-6-17-16(10-14)19(26)18(20(27)22(17,3)4)21(28)24-11-13(2)25;1-12(25)11-24-21(28)18-19(26)16-10-14(15-6-5-9-23-13(15)2)7-8-17(16)22(3,4)20(18)27;1-11(25)8-24-20(28)17-18(26)15-7-12(13-6-14(22)10-23-9-13)4-5-16(15)21(2,3)19(17)27/h5-9,27H,10H2,1-4H3,(H,24,29);2*5-10,26H,11H2,1-4H3,(H,24,28);4-7,9-10,26H,8H2,1-3H3,(H,24,28)
• InChIKey: DACKXBNROWCOJB-UHFFFAOYSA-N
• XLogP: 11.54
• TPSA: 385.44 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 20
• Rotatable Bonds: 16
• Heavy Atoms: 113
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1535.66
LogP ≤ 5	11.54
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_4', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide?

The IUPAC name of 7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide (CID 91071156) is 7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide.

What is the SMILES notation for 7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide?

The canonical SMILES for 7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide is CC(=O)CNC(=O)C1=C(O)c2cc(-c3ccc(C)nc3F)ccc2C(C)(C)C1=O.CC(=O)CNC(=O)C1=C(O)c2cc(-c3cccnc3C)ccc2C(C)(C)C1=O.CC(=O)CNC(=O)C1=C(O)c2cc(-c3ccnc(C)c3)ccc2C(C)(C)C1=O.CC(=O)CNC(=O)C1=C(O)c2cc(-c3cncc(F)c3)ccc2C(C)(C)C1=O.

What is the InChIKey of 7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide?

The InChIKey is DACKXBNROWCOJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21FN2O4.2C22H22N2O4.C21H19FN2O4/c1-11-5-7-14(20(23)25-11)13-6-8-16-15(9-13)18(27)17(19(28)22(16,3)4)21(29)24-10-12(2)26;1-12-9-15(7-8-23-12)14-5-6-17-16(10-14)19(26)18(20(27)22(17,3)4)21(28)24-11-13(2)25;1-12(25)11-24-21(28)18-19(26)16-10-14(15-6-5-9-23-13(15)2)7-8-17(16)22(3,4)20(18)27;1-11(25)8-24-20(28)17-18(26)15-7-12(13-6-14(22)10-23-9-13)4-5-16(15)21(2,3)19(17)27/h5-9,27H,10H2,1-4H3,(H,24,29);2*5-10,26H,11H2,1-4H3,(H,24,28);4-7,9-10,26H,8H2,1-3H3,(H,24,28).

What are the key properties of 7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide?

7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide has a molecular weight of 1535.66 g/mol, XLogP of 11.54, 16 rotatable bonds, 8 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(2-fluoro-6-methyl-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;7-(5-fluoro-3-pyridinyl)-1-hydroxy-4,4-dimethyl-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-3-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide;1-hydroxy-4,4-dimethyl-7-(2-methyl-4-pyridinyl)-3-oxo-N-(2-oxopropyl)naphthalene-2-carboxamide is sourced from PubChem (CID 91071156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).