3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol

C127H166N24O6 — CID 160714883

IUPAC3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol
SMILESCC(C)c1cc2cc(O)c(-c3ccc(N(C)C4CC(C)(C)NC(C)(C)C4)nn3)cc2cn1.CC(C)c1cc2cc(O)c(-c3ccc(OC4CC(C)(C)NC(C)(C)C4)nn3)cc2cn1.CCCc1cc2cc(O)c(-c3ccc(N(C)C4CC(C)(C)NC(C)(C)C4)nn3)cc2cn1.CN(c1ccc(-c2cc3cnc(C4CC4)cc3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.Cc1cc2cc(O)c(-c3ccc(N(C)C4CC(C)(C)NC(C)(C)C4)nn3)cc2cn1
InChIInChI=1S/C26H33N5O.2C26H35N5O.C25H32N4O2.C24H31N5O/c1-25(2)13-19(14-26(3,4)30-25)31(5)24-9-8-21(28-29-24)20-10-18-15-27-22(16-6-7-16)11-17(18)12-23(20)32;1-16(2)22-11-17-12-23(32)20(10-18(17)15-27-22)21-8-9-24(29-28-21)31(7)19-13-25(3,4)30-26(5,6)14-19;1-7-8-19-11-17-13-23(32)21(12-18(17)16-27-19)22-9-10-24(29-28-22)31(6)20-14-25(2,3)30-26(4,5)15-20;1-15(2)21-10-16-11-22(30)19(9-17(16)14-26-21)20-7-8-23(28-27-20)31-18-12-24(3,4)29-25(5,6)13-18;1-15-9-16-11-21(30)19(10-17(16)14-25-15)20-7-8-22(27-26-20)29(6)18-12-23(2,3)28-24(4,5)13-18/h8-12,15-16,19,30,32H,6-7,13-14H2,1-5H3;8-12,15-16,19,30,32H,13-14H2,1-7H3;9-13,16,20,30,32H,7-8,14-15H2,1-6H3;7-11,14-15,18,29-30H,12-13H2,1-6H3;7-11,14,18,28,30H,12-13H2,1-6H3
InChIKeyRSINMEQTVZOHJP-UHFFFAOYSA-N
MW2124.89 g/mol
LogP25.04
Rot. Bonds20

About 3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol

3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol (PubChem CID 160714883) has the molecular formula C127H166N24O6 and a molecular weight of 2124.89 g/mol. Its IUPAC name is 3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol.

Molecular Properties

Compound Name3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol
PubChem CID160714883
Molecular FormulaC127H166N24O6
Molecular Weight2124.89 g/mol
Exact Mass2123.34
IUPAC Name3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol
SMILESCC(C)c1cc2cc(O)c(-c3ccc(N(C)C4CC(C)(C)NC(C)(C)C4)nn3)cc2cn1.CC(C)c1cc2cc(O)c(-c3ccc(OC4CC(C)(C)NC(C)(C)C4)nn3)cc2cn1.CCCc1cc2cc(O)c(-c3ccc(N(C)C4CC(C)(C)NC(C)(C)C4)nn3)cc2cn1.CN(c1ccc(-c2cc3cnc(C4CC4)cc3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.Cc1cc2cc(O)c(-c3ccc(N(C)C4CC(C)(C)NC(C)(C)C4)nn3)cc2cn1
InChIInChI=1S/C26H33N5O.2C26H35N5O.C25H32N4O2.C24H31N5O/c1-25(2)13-19(14-26(3,4)30-25)31(5)24-9-8-21(28-29-24)20-10-18-15-27-22(16-6-7-16)11-17(18)12-23(20)32;1-16(2)22-11-17-12-23(32)20(10-18(17)15-27-22)21-8-9-24(29-28-21)31(7)19-13-25(3,4)30-26(5,6)14-19;1-7-8-19-11-17-13-23(32)21(12-18(17)16-27-19)22-9-10-24(29-28-22)31(6)20-14-25(2,3)30-26(4,5)15-20;1-15(2)21-10-16-11-22(30)19(9-17(16)14-26-21)20-7-8-23(28-27-20)31-18-12-24(3,4)29-25(5,6)13-18;1-15-9-16-11-21(30)19(10-17(16)14-25-15)20-7-8-22(27-26-20)29(6)18-12-23(2,3)28-24(4,5)13-18/h8-12,15-16,19,30,32H,6-7,13-14H2,1-5H3;8-12,15-16,19,30,32H,13-14H2,1-7H3;9-13,16,20,30,32H,7-8,14-15H2,1-6H3;7-11,14-15,18,29-30H,12-13H2,1-6H3;7-11,14,18,28,30H,12-13H2,1-6H3
InChIKeyRSINMEQTVZOHJP-UHFFFAOYSA-N
XLogP25.04
TPSA376.84 Ų
H-Bond Donors10
H-Bond Acceptors30
Rotatable Bonds20
Heavy Atoms157
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002124.89
LogP ≤ 525.04
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1030

Analyze 3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol with MolForge

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Related Compounds

7-(6-(Methyl(2,2,6,6-tetramethylpiperidin-4-yl)amino)pyridazin-3-yl)isoquinolin-6-ol
CID 136607554
7-[6-[[(1S,2S,3R,5R)-2-fluoro-9-azabicyclo[3.3.1]nonan-3-yl]oxy]pyridazin-3-yl]isoquinolin-6-ol
CID 162372792
7-[6-[[(1R,2R,3S,5S)-2-fluoro-9-azabicyclo[3.3.1]nonan-3-yl]oxy]pyridazin-3-yl]isoquinolin-6-ol
CID 162372806
7-[6-[[(2S,3R)-2-fluoro-9-azabicyclo[3.3.1]nonan-3-yl]oxy]pyridazin-3-yl]isoquinolin-6-ol
CID 167360601
7-[6-[[(2R,3S)-2-fluoro-9-azabicyclo[3.3.1]nonan-3-yl]oxy]pyridazin-3-yl]isoquinolin-6-ol
CID 167360613
2-[(3R)-3-[[1-[2-(difluoromethoxy)-4-(trifluoromethyl)phenyl]pyrido[3,4-d]pyridazin-4-yl]amino]piperidin-1-yl]-1-[1-[2,4-di(propan-2-yl)phenyl]-4-[[(3R)-1-methylpiperidin-3-yl]amino]pyrido[3,4-d]pyridazin-5-yl]ethanol
CID 175850034
7-methoxy-4-(4-methoxyphenyl)-N-[1-[[4-(pyridin-4-ylmethoxy)phenyl]methyl]piperidin-4-yl]phthalazin-1-amine
CID 57691745
7-methoxy-4-(4-methoxyphenyl)-N-[1-[[4-(pyridin-4-ylmethoxy)phenyl]methyl]piperidin-4-yl]phthalazin-1-amine;trihydrochloride
CID 68919060
7-methoxy-N-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]-4-pyridin-3-ylphthalazin-1-amine;trihydrochloride
CID 69211777
7-methoxy-N-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]-4-pyridin-3-ylphthalazin-1-amine
CID 69211778
6-(3-(Benzyloxy)isoquinolin-6-yl)-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine
CID 86710698
6-(1-(Benzyloxy)isoquinolin-7-yl)-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine
CID 86710701

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol?
The IUPAC name of 3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol (CID 160714883) is 3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol.
What is the SMILES notation for 3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol?
The canonical SMILES for 3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol is CC(C)c1cc2cc(O)c(-c3ccc(N(C)C4CC(C)(C)NC(C)(C)C4)nn3)cc2cn1.CC(C)c1cc2cc(O)c(-c3ccc(OC4CC(C)(C)NC(C)(C)C4)nn3)cc2cn1.CCCc1cc2cc(O)c(-c3ccc(N(C)C4CC(C)(C)NC(C)(C)C4)nn3)cc2cn1.CN(c1ccc(-c2cc3cnc(C4CC4)cc3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.Cc1cc2cc(O)c(-c3ccc(N(C)C4CC(C)(C)NC(C)(C)C4)nn3)cc2cn1.
What is the InChIKey of 3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol?
The InChIKey is RSINMEQTVZOHJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H33N5O.2C26H35N5O.C25H32N4O2.C24H31N5O/c1-25(2)13-19(14-26(3,4)30-25)31(5)24-9-8-21(28-29-24)20-10-18-15-27-22(16-6-7-16)11-17(18)12-23(20)32;1-16(2)22-11-17-12-23(32)20(10-18(17)15-27-22)21-8-9-24(29-28-21)31(7)19-13-25(3,4)30-26(5,6)14-19;1-7-8-19-11-17-13-23(32)21(12-18(17)16-27-19)22-9-10-24(29-28-22)31(6)20-14-25(2,3)30-26(4,5)15-20;1-15(2)21-10-16-11-22(30)19(9-17(16)14-26-21)20-7-8-23(28-27-20)31-18-12-24(3,4)29-25(5,6)13-18;1-15-9-16-11-21(30)19(10-17(16)14-25-15)20-7-8-22(27-26-20)29(6)18-12-23(2,3)28-24(4,5)13-18/h8-12,15-16,19,30,32H,6-7,13-14H2,1-5H3;8-12,15-16,19,30,32H,13-14H2,1-7H3;9-13,16,20,30,32H,7-8,14-15H2,1-6H3;7-11,14-15,18,29-30H,12-13H2,1-6H3;7-11,14,18,28,30H,12-13H2,1-6H3.
What are the key properties of 3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol?
3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol has a molecular weight of 2124.89 g/mol, XLogP of 25.04, 20 rotatable bonds, 10 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propan-2-ylisoquinolin-6-ol;7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-propylisoquinolin-6-ol;3-propan-2-yl-7-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]isoquinolin-6-ol is sourced from PubChem (CID 160714883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).