1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol

C127H161N25O9 — CID 158637016

IUPAC1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol
SMILESCN(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.CN(c1ccc(-c2ccc(C3=CCNCC3)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.C25H31N5O2.C25H35N5O.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;1-24(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)15-19(16-25(3,4)29-24)30(5)23-9-8-21(27-28-23)20-7-6-18(14-22(20)31)17-10-12-26-13-11-17;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;6-11,14-15,18,29,31-32H,12-13H2,1-5H3;6-10,14,19,26,29,31H,11-13,15-16H2,1-5H3;6-13,18,28,30H,14-15H2,1-5H3;6-10,13-15,18,29,31H,11-12H2,1-5H3
InChIKeyHZWYACSIFSKJMN-UHFFFAOYSA-N
MW2181.85 g/mol
LogP21.05
Rot. Bonds21

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-[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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol

1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol (PubChem CID 158637016) has the molecular formula C127H161N25O9 and a molecular weight of 2181.85 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-[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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol.

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-[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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol
PubChem CID158637016
Molecular FormulaC127H161N25O9
Molecular Weight2181.85 g/mol
Exact Mass2180.29
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-[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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol
SMILESCN(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.CN(c1ccc(-c2ccc(C3=CCNCC3)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.C25H31N5O2.C25H35N5O.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;1-24(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)15-19(16-25(3,4)29-24)30(5)23-9-8-21(27-28-23)20-7-6-18(14-22(20)31)17-10-12-26-13-11-17;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;6-11,14-15,18,29,31-32H,12-13H2,1-5H3;6-10,14,19,26,29,31H,11-13,15-16H2,1-5H3;6-13,18,28,30H,14-15H2,1-5H3;6-10,13-15,18,29,31H,11-12H2,1-5H3
InChIKeyHZWYACSIFSKJMN-UHFFFAOYSA-N
XLogP21.05
TPSA427.32 Ų
H-Bond Donors12
H-Bond Acceptors34
Rotatable Bonds21
Heavy Atoms161
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002181.85
LogP ≤ 521.05
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1034

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-[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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol 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-[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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol?
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-[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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol (CID 158637016) 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-[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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol.
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-[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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol?
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-[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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol is 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.CN(c1ccc(-c2ccc(C3=CCNCC3)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-[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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol?
The InChIKey is HZWYACSIFSKJMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H35N5O2.C25H31N5O2.C25H35N5O.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;1-24(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)15-19(16-25(3,4)29-24)30(5)23-9-8-21(27-28-23)20-7-6-18(14-22(20)31)17-10-12-26-13-11-17;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;6-11,14-15,18,29,31-32H,12-13H2,1-5H3;6-10,14,19,26,29,31H,11-13,15-16H2,1-5H3;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-[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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol?
1-cyclopropyl-4-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]pyridin-2-one;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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol has a molecular weight of 2181.85 g/mol, XLogP of 21.05, 21 rotatable bonds, 12 hydrogen bond donors, and 34 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-[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;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)phenol is sourced from PubChem (CID 158637016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).