6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide

C48H60N12O4 — CID 157064089

IUPAC6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide
SMILESCN(c1ccc(-c2cc3ccc(C(N)=O)nc3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc3nc(C(N)=O)ccc3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/2C24H30N6O2/c1-23(2)12-15(13-24(3,4)29-23)30(5)21-9-8-17(27-28-21)16-11-19-14(10-20(16)31)6-7-18(26-19)22(25)32;1-23(2)12-15(13-24(3,4)29-23)30(5)21-9-8-17(27-28-21)16-10-14-6-7-18(22(25)32)26-19(14)11-20(16)31/h2*6-11,15,29,31H,12-13H2,1-5H3,(H2,25,32)
InChIKeyABRAGZBPJYQKLC-UHFFFAOYSA-N
MW869.09 g/mol
LogP6.48
Rot. Bonds8

About 6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide

6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide (PubChem CID 157064089) has the molecular formula C48H60N12O4 and a molecular weight of 869.09 g/mol. Its IUPAC name is 6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide.

Molecular Properties

Compound Name6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide
PubChem CID157064089
Molecular FormulaC48H60N12O4
Molecular Weight869.09 g/mol
Exact Mass868.49
IUPAC Name6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide
SMILESCN(c1ccc(-c2cc3ccc(C(N)=O)nc3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc3nc(C(N)=O)ccc3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/2C24H30N6O2/c1-23(2)12-15(13-24(3,4)29-23)30(5)21-9-8-17(27-28-21)16-11-19-14(10-20(16)31)6-7-18(26-19)22(25)32;1-23(2)12-15(13-24(3,4)29-23)30(5)21-9-8-17(27-28-21)16-10-14-6-7-18(22(25)32)26-19(14)11-20(16)31/h2*6-11,15,29,31H,12-13H2,1-5H3,(H2,25,32)
InChIKeyABRAGZBPJYQKLC-UHFFFAOYSA-N
XLogP6.48
TPSA234.52 Ų
H-Bond Donors6
H-Bond Acceptors14
Rotatable Bonds8
Heavy Atoms64
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 500869.09
LogP ≤ 56.48
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1014

Analyze 6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[6-[[(1S,5R)-1,5-dimethyl-9-azabicyclo[3.3.1]nonan-3-yl]-methylamino]pyridazin-3-yl]-7-hydroxy-N-methylquinoline-2-carboxamide
CID 154598923
6-[6-[[(1S,5R)-1,5-dimethyl-9-azabicyclo[3.3.1]nonan-3-yl]-methylamino]pyridazin-3-yl]-3-fluoro-7-hydroxy-N-methylquinoline-2-carboxamide
CID 155407676
6-[6-[[(1R,5S)-1,5-dimethyl-3-bicyclo[3.3.1]nonanyl]-methylamino]pyridazin-3-yl]-3-fluoro-7-hydroxy-N-methylquinoline-2-carboxamide
CID 155407678
6-Hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]isoquinoline-1-carboxamide
CID 136607617
6-Hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide
CID 136607618
7-Hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide
CID 136639493
6-Hydroxy-3-methyl-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxylic acid
CID 137046691
6-Hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxylic acid
CID 141443165
7-[6-[[(1R,5S)-1,5-dimethyl-9-azabicyclo[3.3.1]nonan-3-yl]-methylamino]pyridazin-3-yl]-6-hydroxy-N-methylisoquinoline-3-carboxamide
CID 154598774
6-[6-[[(1R,5S)-1,5-dimethyl-3-bicyclo[3.3.1]nonanyl]-methylamino]pyridazin-3-yl]-7-hydroxy-N-methylquinoline-2-carboxamide
CID 154987923
7-hydroxy-N-methyl-6-[6-[methyl-[(1S,3R)-3-methyl-3-propylcycloheptyl]amino]pyridazin-3-yl]quinoline-2-carboxamide
CID 155041179
7-hydroxy-6-[6-[[(1S,5R)-9-hydroxy-1,5-dimethyl-9-azabicyclo[3.3.1]nonan-3-yl]-methylamino]pyridazin-3-yl]-N-methylquinoline-2-carboxamide
CID 155407392

Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide?
The IUPAC name of 6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide (CID 157064089) is 6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide.
What is the SMILES notation for 6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide?
The canonical SMILES for 6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide is CN(c1ccc(-c2cc3ccc(C(N)=O)nc3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ccc(-c2cc3nc(C(N)=O)ccc3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide?
The InChIKey is ABRAGZBPJYQKLC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C24H30N6O2/c1-23(2)12-15(13-24(3,4)29-23)30(5)21-9-8-17(27-28-21)16-11-19-14(10-20(16)31)6-7-18(26-19)22(25)32;1-23(2)12-15(13-24(3,4)29-23)30(5)21-9-8-17(27-28-21)16-10-14-6-7-18(22(25)32)26-19(14)11-20(16)31/h2*6-11,15,29,31H,12-13H2,1-5H3,(H2,25,32).
What are the key properties of 6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide?
6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide has a molecular weight of 869.09 g/mol, XLogP of 6.48, 8 rotatable bonds, 6 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-7-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide;7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide is sourced from PubChem (CID 157064089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).