1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol

C129H162N26O9 — CID 158845670

IUPAC1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol
SMILESCN(C)c1ccc(-c2ccc(-c3ccc(N(C)C4CC(C)(C)NC(C)(C)C4)nn3)c(O)c2)cn1.CN(c1ccc(-c2ccc(-c3ccn(C4CC4)c(=O)c3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2ccc(-c3cncc(O)c3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2ccc(-c3cncnc3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.Cn1ccc(-c2ccc(-c3ccc(OC4CC(C)(C)NC(C)(C)C4)nn3)c(O)c2)cc1=O
InChIInChI=1S/C28H35N5O2.C27H36N6O.C25H31N5O2.C25H30N4O3.C24H30N6O/c1-27(2)16-21(17-28(3,4)31-27)32(5)25-11-10-23(29-30-25)22-9-6-18(14-24(22)34)19-12-13-33(20-7-8-20)26(35)15-19;1-26(2)15-20(16-27(3,4)31-26)33(7)25-13-11-22(29-30-25)21-10-8-18(14-23(21)34)19-9-12-24(28-17-19)32(5)6;1-24(2)12-18(13-25(3,4)29-24)30(5)23-9-8-21(27-28-23)20-7-6-16(11-22(20)32)17-10-19(31)15-26-14-17;1-24(2)14-18(15-25(3,4)28-24)32-22-9-8-20(26-27-22)19-7-6-16(12-21(19)30)17-10-11-29(5)23(31)13-17;1-23(2)11-18(12-24(3,4)29-23)30(5)22-9-8-20(27-28-22)19-7-6-16(10-21(19)31)17-13-25-15-26-14-17/h6,9-15,20-21,31,34H,7-8,16-17H2,1-5H3;8-14,17,20,31,34H,15-16H2,1-7H3;6-11,14-15,18,29,31-32H,12-13H2,1-5H3;6-13,18,28,30H,14-15H2,1-5H3;6-10,13-15,18,29,31H,11-12H2,1-5H3
InChIKeyIYUJTZGZFUTVNS-UHFFFAOYSA-N
MW2220.89 g/mol
LogP21.80
Rot. Bonds22

About 1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol

1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol (PubChem CID 158845670) has the molecular formula C129H162N26O9 and a molecular weight of 2220.89 g/mol. Its IUPAC name is 1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol.

Molecular Properties

Compound Name1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol
PubChem CID158845670
Molecular FormulaC129H162N26O9
Molecular Weight2220.89 g/mol
Exact Mass2219.30
IUPAC Name1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol
SMILESCN(C)c1ccc(-c2ccc(-c3ccc(N(C)C4CC(C)(C)NC(C)(C)C4)nn3)c(O)c2)cn1.CN(c1ccc(-c2ccc(-c3ccn(C4CC4)c(=O)c3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2ccc(-c3cncc(O)c3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2ccc(-c3cncnc3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.Cn1ccc(-c2ccc(-c3ccc(OC4CC(C)(C)NC(C)(C)C4)nn3)c(O)c2)cc1=O
InChIInChI=1S/C28H35N5O2.C27H36N6O.C25H31N5O2.C25H30N4O3.C24H30N6O/c1-27(2)16-21(17-28(3,4)31-27)32(5)25-11-10-23(29-30-25)22-9-6-18(14-24(22)34)19-12-13-33(20-7-8-20)26(35)15-19;1-26(2)15-20(16-27(3,4)31-26)33(7)25-13-11-22(29-30-25)21-10-8-18(14-23(21)34)19-9-12-24(28-17-19)32(5)6;1-24(2)12-18(13-25(3,4)29-24)30(5)23-9-8-21(27-28-23)20-7-6-16(11-22(20)32)17-10-19(31)15-26-14-17;1-24(2)14-18(15-25(3,4)28-24)32-22-9-8-20(26-27-22)19-7-6-16(12-21(19)30)17-10-11-29(5)23(31)13-17;1-23(2)11-18(12-24(3,4)29-23)30(5)22-9-8-20(27-28-22)19-7-6-16(10-21(19)31)17-13-25-15-26-14-17/h6,9-15,20-21,31,34H,7-8,16-17H2,1-5H3;8-14,17,20,31,34H,15-16H2,1-7H3;6-11,14-15,18,29,31-32H,12-13H2,1-5H3;6-13,18,28,30H,14-15H2,1-5H3;6-10,13-15,18,29,31H,11-12H2,1-5H3
InChIKeyIYUJTZGZFUTVNS-UHFFFAOYSA-N
XLogP21.80
TPSA431.42 Ų
H-Bond Donors11
H-Bond Acceptors35
Rotatable Bonds22
Heavy Atoms164
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002220.89
LogP ≤ 521.80
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1035

Analyze 1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol?
The IUPAC name of 1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol (CID 158845670) is 1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol.
What is the SMILES notation for 1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol?
The canonical SMILES for 1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol is CN(C)c1ccc(-c2ccc(-c3ccc(N(C)C4CC(C)(C)NC(C)(C)C4)nn3)c(O)c2)cn1.CN(c1ccc(-c2ccc(-c3ccn(C4CC4)c(=O)c3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2ccc(-c3cncc(O)c3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2ccc(-c3cncnc3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.Cn1ccc(-c2ccc(-c3ccc(OC4CC(C)(C)NC(C)(C)C4)nn3)c(O)c2)cc1=O.
What is the InChIKey of 1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol?
The InChIKey is IYUJTZGZFUTVNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H35N5O2.C27H36N6O.C25H31N5O2.C25H30N4O3.C24H30N6O/c1-27(2)16-21(17-28(3,4)31-27)32(5)25-11-10-23(29-30-25)22-9-6-18(14-24(22)34)19-12-13-33(20-7-8-20)26(35)15-19;1-26(2)15-20(16-27(3,4)31-26)33(7)25-13-11-22(29-30-25)21-10-8-18(14-23(21)34)19-9-12-24(28-17-19)32(5)6;1-24(2)12-18(13-25(3,4)29-24)30(5)23-9-8-21(27-28-23)20-7-6-16(11-22(20)32)17-10-19(31)15-26-14-17;1-24(2)14-18(15-25(3,4)28-24)32-22-9-8-20(26-27-22)19-7-6-16(12-21(19)30)17-10-11-29(5)23(31)13-17;1-23(2)11-18(12-24(3,4)29-23)30(5)22-9-8-20(27-28-22)19-7-6-16(10-21(19)31)17-13-25-15-26-14-17/h6,9-15,20-21,31,34H,7-8,16-17H2,1-5H3;8-14,17,20,31,34H,15-16H2,1-7H3;6-11,14-15,18,29,31-32H,12-13H2,1-5H3;6-13,18,28,30H,14-15H2,1-5H3;6-10,13-15,18,29,31H,11-12H2,1-5H3.
What are the key properties of 1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol?
1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol has a molecular weight of 2220.89 g/mol, XLogP of 21.80, 22 rotatable bonds, 11 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;5-[6-(dimethylamino)-3-pyridinyl]-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-3-ol;4-[3-hydroxy-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-1-methylpyridin-2-one;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-pyrimidin-5-ylphenol is sourced from PubChem (CID 158845670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).