4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol

C153H199N33O6 — CID 158529774

IUPAC4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol
SMILESCN(c1ccc(-c2cc(-c3cc4ccccc4[nH]3)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(-c3ccn[nH]3)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(-c3cnn4c3CCCC4)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(-c3cnn4c3CNCC4)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(C3=CCCC3)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(C3=CCN=C3)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C28H33N5O.C27H36N6O.C26H35N7O.C25H34N4O.C24H31N5O.C23H30N6O/c1-27(2)16-20(17-28(3,4)32-27)33(5)26-13-11-23(30-31-26)21-14-19(10-12-25(21)34)24-15-18-8-6-7-9-22(18)29-24;1-26(2)15-19(16-27(3,4)31-26)32(5)25-12-10-22(29-30-25)20-14-18(9-11-24(20)34)21-17-28-33-13-7-6-8-23(21)33;1-25(2)13-18(14-26(3,4)31-25)32(5)24-9-7-21(29-30-24)19-12-17(6-8-23(19)34)20-15-28-33-11-10-27-16-22(20)33;1-24(2)15-19(16-25(3,4)28-24)29(5)23-13-11-21(26-27-23)20-14-18(10-12-22(20)30)17-8-6-7-9-17;1-23(2)13-18(14-24(3,4)28-23)29(5)22-9-7-20(26-27-22)19-12-16(6-8-21(19)30)17-10-11-25-15-17;1-22(2)13-16(14-23(3,4)28-22)29(5)21-9-7-19(26-27-21)17-12-15(6-8-20(17)30)18-10-11-24-25-18/h6-15,20,29,32,34H,16-17H2,1-5H3;9-12,14,17,19,31,34H,6-8,13,15-16H2,1-5H3;6-9,12,15,18,27,31,34H,10-11,13-14,16H2,1-5H3;8,10-14,19,28,30H,6-7,9,15-16H2,1-5H3;6-10,12,15,18,28,30H,11,13-14H2,1-5H3;6-12,16,28,30H,13-14H2,1-5H3,(H,24,25)
InChIKeyHNFKTILYGIEQPT-UHFFFAOYSA-N
MW2596.50 g/mol
LogP27.31
Rot. Bonds24

About 4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol

4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol (PubChem CID 158529774) has the molecular formula C153H199N33O6 and a molecular weight of 2596.50 g/mol. Its IUPAC name is 4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol.

Molecular Properties

Compound Name4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol
PubChem CID158529774
Molecular FormulaC153H199N33O6
Molecular Weight2596.50 g/mol
Exact Mass2594.63
IUPAC Name4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol
SMILESCN(c1ccc(-c2cc(-c3cc4ccccc4[nH]3)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(-c3ccn[nH]3)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(-c3cnn4c3CCCC4)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(-c3cnn4c3CNCC4)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(C3=CCCC3)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(C3=CCN=C3)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C28H33N5O.C27H36N6O.C26H35N7O.C25H34N4O.C24H31N5O.C23H30N6O/c1-27(2)16-20(17-28(3,4)32-27)33(5)26-13-11-23(30-31-26)21-14-19(10-12-25(21)34)24-15-18-8-6-7-9-22(18)29-24;1-26(2)15-19(16-27(3,4)31-26)32(5)25-12-10-22(29-30-25)20-14-18(9-11-24(20)34)21-17-28-33-13-7-6-8-23(21)33;1-25(2)13-18(14-26(3,4)31-25)32(5)24-9-7-21(29-30-24)19-12-17(6-8-23(19)34)20-15-28-33-11-10-27-16-22(20)33;1-24(2)15-19(16-25(3,4)28-24)29(5)23-13-11-21(26-27-23)20-14-18(10-12-22(20)30)17-8-6-7-9-17;1-23(2)13-18(14-24(3,4)28-23)29(5)22-9-7-20(26-27-22)19-12-16(6-8-21(19)30)17-10-11-25-15-17;1-22(2)13-16(14-23(3,4)28-22)29(5)21-9-7-19(26-27-21)17-12-15(6-8-20(17)30)18-10-11-24-25-18/h6-15,20,29,32,34H,16-17H2,1-5H3;9-12,14,17,19,31,34H,6-8,13,15-16H2,1-5H3;6-9,12,15,18,27,31,34H,10-11,13-14,16H2,1-5H3;8,10-14,19,28,30H,6-7,9,15-16H2,1-5H3;6-10,12,15,18,28,30H,11,13-14H2,1-5H3;6-12,16,28,30H,13-14H2,1-5H3,(H,24,25)
InChIKeyHNFKTILYGIEQPT-UHFFFAOYSA-N
XLogP27.31
TPSA472.18 Ų
H-Bond Donors15
H-Bond Acceptors37
Rotatable Bonds24
Heavy Atoms192
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002596.50
LogP ≤ 527.31
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1037

Analyze 4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol with MolForge

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Related Compounds

4-[1-(3-aminoprop-1-ynyl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridin-7-yl]cyclohexa-2,4-dien-1-ol;4-[C-(cyclohexen-1-yl)-N-(3-morpholin-4-yl-1H-indazol-5-yl)carbonimidoyl]phenol;4-[4-[5-ethenyl-3-[3-(4-methylpiperazin-1-yl)prop-1-ynyl]-4,5-dihydro-1H-pyrazol-4-yl]-5,6,7,8-tetrahydroisoquinolin-1-yl]cyclohexa-2,4-dien-1-ol;4-[9-methyl-1-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-8-propyl-3H-pyrazolo[4,3-f]quinolin-7-yl]cyclohexa-2,4-dien-1-ol
CID 160914759
4-[cyclohexen-1-yl-(1H-indazol-5-ylamino)methyl]benzenecarboximidamide;2,5-difluoro-4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)phenol;7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-amine;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)-2-(trifluoromethyl)phenol
CID 161959151
4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol
CID 137046698
2-[3-(2-azaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;2-[3-(7-azaspiro[3.5]nonan-7-yl)-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazo[1,2-b]pyridazin-6-yl-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(1H-indazol-5-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-methylpyrazol-1-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol
CID 157075745
5-[2-(Dimethylamino)-4-pyridinyl]-2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)triazolo[4,5-c]pyridazin-6-yl]phenol;5-(3-fluoro-4-pyridinyl)-2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)triazolo[4,5-c]pyridazin-6-yl]phenol;5-(1-methylpyrazol-4-yl)-2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)triazolo[4,5-c]pyridazin-6-yl]phenol
CID 157337418
3-[2,5-difluoro-4-(1H-pyrazol-4-yl)phenyl]-6-methyl-7-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridazine;3-[2,5-difluoro-4-(1H-pyrazol-4-yl)phenyl]-7-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridazine;2-[6-methyl-7-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridazin-3-yl]-5-(1H-pyrazol-4-yl)phenol
CID 157450231
2-(1-piperidin-4-ylpyrazolo[3,4-b]pyrazin-5-yl)-5-(1H-pyrazol-4-yl)phenol;2-(1-piperidin-4-ylpyrazolo[3,4-c]pyridazin-5-yl)-5-(1H-pyrazol-4-yl)phenol;5-(1H-pyrazol-4-yl)-2-[7-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)-5H-pyrrolo[3,2-c]pyridazin-3-yl]phenol
CID 157664200
2-(7-piperidin-4-yl-5H-pyrrolo[3,2-c]pyridazin-3-yl)-5-(1H-pyrazol-4-yl)phenol;5-(1H-pyrazol-4-yl)-2-[7-(1,2,3,6-tetrahydropyridin-4-yl)-5H-pyrrolo[3,2-c]pyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[5-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolo[2,3-b]pyrazin-2-yl]phenol
CID 157682328
2-[3-[3-(dimethylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(2-methyltetrazol-5-yl)phenol;5-(1-methylindazol-5-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol
CID 157685261
2-[3-[3-(tert-butylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-imidazol-1-ylphenol;2-[3-(2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;2-[3-(2-methyl-2,9-diazaspiro[5.5]undecan-9-yl)-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1-methyltriazolo[4,5-b]pyridin-5-yl)phenol;2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-quinolin-6-ylphenol
CID 157801383
2-[3-[3-(tert-butylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(4-methylimidazol-1-yl)phenol;5-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(1-methylpyrazol-4-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-3-yl]phenol;5-(1-methylpyrazol-4-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazolo[3,4-b]pyrazin-5-yl)phenol;2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazolo[4,3-d]pyrimidin-5-yl)phenol
CID 157839013
2-[3-[(3S,4R)-3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl]triazolo[4,5-c]pyridazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-pyridin-3-yl-2-[1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrazolo[3,4-c]pyridazin-5-yl]phenol;5-pyrimidin-5-yl-2-[1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrazolo[3,4-c]pyridazin-5-yl]phenol
CID 157848026

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol?
The IUPAC name of 4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol (CID 158529774) is 4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol.
What is the SMILES notation for 4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol?
The canonical SMILES for 4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol is CN(c1ccc(-c2cc(-c3cc4ccccc4[nH]3)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(-c3ccn[nH]3)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(-c3cnn4c3CCCC4)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(-c3cnn4c3CNCC4)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(C3=CCCC3)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc(C3=CCN=C3)ccc2O)nn1)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol?
The InChIKey is HNFKTILYGIEQPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H33N5O.C27H36N6O.C26H35N7O.C25H34N4O.C24H31N5O.C23H30N6O/c1-27(2)16-20(17-28(3,4)32-27)33(5)26-13-11-23(30-31-26)21-14-19(10-12-25(21)34)24-15-18-8-6-7-9-22(18)29-24;1-26(2)15-19(16-27(3,4)31-26)32(5)25-12-10-22(29-30-25)20-14-18(9-11-24(20)34)21-17-28-33-13-7-6-8-23(21)33;1-25(2)13-18(14-26(3,4)31-25)32(5)24-9-7-21(29-30-24)19-12-17(6-8-23(19)34)20-15-28-33-11-10-27-16-22(20)33;1-24(2)15-19(16-25(3,4)28-24)29(5)23-13-11-21(26-27-23)20-14-18(10-12-22(20)30)17-8-6-7-9-17;1-23(2)13-18(14-24(3,4)28-23)29(5)22-9-7-20(26-27-22)19-12-16(6-8-21(19)30)17-10-11-25-15-17;1-22(2)13-16(14-23(3,4)28-22)29(5)21-9-7-19(26-27-21)17-12-15(6-8-20(17)30)18-10-11-24-25-18/h6-15,20,29,32,34H,16-17H2,1-5H3;9-12,14,17,19,31,34H,6-8,13,15-16H2,1-5H3;6-9,12,15,18,27,31,34H,10-11,13-14,16H2,1-5H3;8,10-14,19,28,30H,6-7,9,15-16H2,1-5H3;6-10,12,15,18,28,30H,11,13-14H2,1-5H3;6-12,16,28,30H,13-14H2,1-5H3,(H,24,25).
What are the key properties of 4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol?
4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol has a molecular weight of 2596.50 g/mol, XLogP of 27.31, 24 rotatable bonds, 15 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopenten-1-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;4-(1H-indol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(1H-pyrazol-5-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(2H-pyrrol-4-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)phenol is sourced from PubChem (CID 158529774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).