6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum

C113H108F10N17O10Pt5-5 — CID 161050457

IUPAC6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum
SMILESCC(C)(C)C(c1cccc(C(=O)O)n1)(c1cccc(-c2[c-]cc(F)nc2F)n1)C(C)(C)C.CC(C)CC(CC(C)C)(c1cccc(C(=O)O)n1)c1cccc(-c2[c-]cc(F)nc2F)n1.CCC(CC)(c1cccc(C(=O)O)n1)c1cccc(-c2[c-]cc(F)nc2F)n1.CN(C)c1cc(-c2[c-]cc(F)nc2F)nc(C(C)(C)c2cccc(C(=O)O)n2)c1.CN(C)c1cc(C(=O)O)nc(C(C)(C)c2cccc(-c3[c-]cc(F)nc3F)n2)c1.[Pt].[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/2C25H26F2N3O2.2C21H19F2N4O2.C21H18F2N3O2.5Pt/c1-23(2,3)25(24(4,5)6,19-12-8-10-17(29-19)22(31)32)18-11-7-9-16(28-18)15-13-14-20(26)30-21(15)27;1-15(2)13-25(14-16(3)4,21-10-6-8-19(29-21)24(31)32)20-9-5-7-18(28-20)17-11-12-22(26)30-23(17)27;1-21(2,16-7-5-6-14(24-16)20(28)29)17-11-12(27(3)4)10-15(25-17)13-8-9-18(22)26-19(13)23;1-21(2,17-11-12(27(3)4)10-15(25-17)20(28)29)16-7-5-6-14(24-16)13-8-9-18(22)26-19(13)23;1-3-21(4-2,17-10-6-8-15(25-17)20(27)28)16-9-5-7-14(24-16)13-11-12-18(22)26-19(13)23;;;;;/h7-12,14H,1-6H3,(H,31,32);5-10,12,15-16H,13-14H2,1-4H3,(H,31,32);2*5-7,9-11H,1-4H3,(H,28,29);5-10,12H,3-4H2,1-2H3,(H,27,28);;;;;/q5*-1;;;;;
InChIKeyFYBSWHFCZLGNTB-UHFFFAOYSA-N
MW3029.59 g/mol
LogP23.21
Rot. Bonds28

About 6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum

6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum (PubChem CID 161050457) has the molecular formula C113H108F10N17O10Pt5-5 and a molecular weight of 3029.59 g/mol. Its IUPAC name is 6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum.

Molecular Properties

Compound Name6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum
PubChem CID161050457
Molecular FormulaC113H108F10N17O10Pt5-5
Molecular Weight3029.59 g/mol
Exact Mass3027.66
IUPAC Name6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum
SMILESCC(C)(C)C(c1cccc(C(=O)O)n1)(c1cccc(-c2[c-]cc(F)nc2F)n1)C(C)(C)C.CC(C)CC(CC(C)C)(c1cccc(C(=O)O)n1)c1cccc(-c2[c-]cc(F)nc2F)n1.CCC(CC)(c1cccc(C(=O)O)n1)c1cccc(-c2[c-]cc(F)nc2F)n1.CN(C)c1cc(-c2[c-]cc(F)nc2F)nc(C(C)(C)c2cccc(C(=O)O)n2)c1.CN(C)c1cc(C(=O)O)nc(C(C)(C)c2cccc(-c3[c-]cc(F)nc3F)n2)c1.[Pt].[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/2C25H26F2N3O2.2C21H19F2N4O2.C21H18F2N3O2.5Pt/c1-23(2,3)25(24(4,5)6,19-12-8-10-17(29-19)22(31)32)18-11-7-9-16(28-18)15-13-14-20(26)30-21(15)27;1-15(2)13-25(14-16(3)4,21-10-6-8-19(29-21)24(31)32)20-9-5-7-18(28-20)17-11-12-22(26)30-23(17)27;1-21(2,16-7-5-6-14(24-16)20(28)29)17-11-12(27(3)4)10-15(25-17)13-8-9-18(22)26-19(13)23;1-21(2,17-11-12(27(3)4)10-15(25-17)20(28)29)16-7-5-6-14(24-16)13-8-9-18(22)26-19(13)23;1-3-21(4-2,17-10-6-8-15(25-17)20(27)28)16-9-5-7-14(24-16)13-11-12-18(22)26-19(13)23;;;;;/h7-12,14H,1-6H3,(H,31,32);5-10,12,15-16H,13-14H2,1-4H3,(H,31,32);2*5-7,9-11H,1-4H3,(H,28,29);5-10,12H,3-4H2,1-2H3,(H,27,28);;;;;/q5*-1;;;;;
InChIKeyFYBSWHFCZLGNTB-UHFFFAOYSA-N
XLogP23.21
TPSA386.33 Ų
H-Bond Donors5
H-Bond Acceptors22
Rotatable Bonds28
Heavy Atoms155
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003029.59
LogP ≤ 523.21
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

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

Analyze 6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum?
The IUPAC name of 6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum (CID 161050457) is 6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum.
What is the SMILES notation for 6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum?
The canonical SMILES for 6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum is CC(C)(C)C(c1cccc(C(=O)O)n1)(c1cccc(-c2[c-]cc(F)nc2F)n1)C(C)(C)C.CC(C)CC(CC(C)C)(c1cccc(C(=O)O)n1)c1cccc(-c2[c-]cc(F)nc2F)n1.CCC(CC)(c1cccc(C(=O)O)n1)c1cccc(-c2[c-]cc(F)nc2F)n1.CN(C)c1cc(-c2[c-]cc(F)nc2F)nc(C(C)(C)c2cccc(C(=O)O)n2)c1.CN(C)c1cc(C(=O)O)nc(C(C)(C)c2cccc(-c3[c-]cc(F)nc3F)n2)c1.[Pt].[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum?
The InChIKey is FYBSWHFCZLGNTB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C25H26F2N3O2.2C21H19F2N4O2.C21H18F2N3O2.5Pt/c1-23(2,3)25(24(4,5)6,19-12-8-10-17(29-19)22(31)32)18-11-7-9-16(28-18)15-13-14-20(26)30-21(15)27;1-15(2)13-25(14-16(3)4,21-10-6-8-19(29-21)24(31)32)20-9-5-7-18(28-20)17-11-12-22(26)30-23(17)27;1-21(2,16-7-5-6-14(24-16)20(28)29)17-11-12(27(3)4)10-15(25-17)13-8-9-18(22)26-19(13)23;1-21(2,17-11-12(27(3)4)10-15(25-17)20(28)29)16-7-5-6-14(24-16)13-8-9-18(22)26-19(13)23;1-3-21(4-2,17-10-6-8-15(25-17)20(27)28)16-9-5-7-14(24-16)13-11-12-18(22)26-19(13)23;;;;;/h7-12,14H,1-6H3,(H,31,32);5-10,12,15-16H,13-14H2,1-4H3,(H,31,32);2*5-7,9-11H,1-4H3,(H,28,29);5-10,12H,3-4H2,1-2H3,(H,27,28);;;;;/q5*-1;;;;;.
What are the key properties of 6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum?
6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum has a molecular weight of 3029.59 g/mol, XLogP of 23.21, 28 rotatable bonds, 5 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-4-(dimethylamino)-2-pyridinyl]propan-2-yl]pyridine-2-carboxylic acid;6-[4-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,6-dimethylheptan-4-yl]pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]pentan-3-yl]pyridine-2-carboxylic acid;6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(dimethylamino)pyridine-2-carboxylic acid;6-[3-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine-2-carboxylic acid;platinum is sourced from PubChem (CID 161050457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).