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

C23H29N5O2 — CID 136607507

IUPAC6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol
SMILESCN(c1ccc(-c2cc3cc(O)cnc3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C23H29N5O2/c1-22(2)11-15(12-23(3,4)27-22)28(5)21-7-6-18(25-26-21)17-9-14-8-16(29)13-24-19(14)10-20(17)30/h6-10,13,15,27,29-30H,11-12H2,1-5H3
InChIKeyHTFHFUDOJSBNJA-UHFFFAOYSA-N
MW407.52 g/mol
LogP3.85
Rot. Bonds3

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

6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol (PubChem CID 136607507) has the molecular formula C23H29N5O2 and a molecular weight of 407.52 g/mol. Its IUPAC name is 6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol.

Molecular Properties

Compound Name6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol
PubChem CID136607507
Molecular FormulaC23H29N5O2
Molecular Weight407.52 g/mol
Exact Mass407.23
IUPAC Name6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol
SMILESCN(c1ccc(-c2cc3cc(O)cnc3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C23H29N5O2/c1-22(2)11-15(12-23(3,4)27-22)28(5)21-7-6-18(25-26-21)17-9-14-8-16(29)13-24-19(14)10-20(17)30/h6-10,13,15,27,29-30H,11-12H2,1-5H3
InChIKeyHTFHFUDOJSBNJA-UHFFFAOYSA-N
XLogP3.85
TPSA94.40 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.52
LogP ≤ 53.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol 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-[Methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-7-ol
CID 136607508
7-(6-(Methyl(2,2,6,6-tetramethylpiperidin-4-yl)amino)pyridazin-3-yl)isoquinolin-6-ol
CID 136607554
5-methyl-2-[4-[[(3R)-1-methylpiperidin-3-yl]amino]phthalazin-1-yl]pyridin-3-ol
CID 166151232
7-[6-[[(1S,2S,3R,5R)-2-fluoro-9-azabicyclo[3.3.1]nonan-3-yl]-methylamino]pyridazin-3-yl]isoquinolin-6-ol
CID 154676839
7-[6-[[(1S,2S,3R,5R)-2-fluoro-8-azabicyclo[3.2.1]octan-3-yl]-methylamino]pyridazin-3-yl]isoquinolin-6-ol
CID 154676907
5-(7-Fluoro-2-methylindazol-5-yl)-2-[6-(3-methylpiperazin-1-yl)pyridazin-3-yl]pyridin-3-ol
CID 155287111
5-(7-fluoro-2-methylindazol-5-yl)-2-[6-[(3S)-3-propan-2-ylpiperazin-1-yl]pyridazin-3-yl]pyridin-3-ol
CID 155287166
2-[6-[(5,5-Dimethyl-4-azaspiro[2.5]octan-7-yl)-methylamino]pyridazin-3-yl]-5-(7-fluoro-2-methylindazol-5-yl)pyridin-3-ol
CID 155287181
2-[6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyridazin-3-yl]-5-(7-fluoro-2-methylindazol-5-yl)pyridin-3-ol
CID 155287202
5-(7-Fluoro-2-methylindazol-5-yl)-2-[6-(3,3,5,5-tetramethylpiperazin-1-yl)pyridazin-3-yl]pyridin-3-ol
CID 155287309
2-[6-(3-Ethylpiperazin-1-yl)pyridazin-3-yl]-5-(7-fluoro-2-methylindazol-5-yl)pyridin-3-ol
CID 155287348
5-(7-fluoro-2-methylindazol-5-yl)-2-[6-[(3R)-3-methylpiperazin-1-yl]pyridazin-3-yl]pyridin-3-ol
CID 155287399

Frequently Asked Questions

What is the IUPAC name of 6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol?
The IUPAC name of 6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol (CID 136607507) is 6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol.
What is the SMILES notation for 6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol?
The canonical SMILES for 6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol is CN(c1ccc(-c2cc3cc(O)cnc3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol?
The InChIKey is HTFHFUDOJSBNJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N5O2/c1-22(2)11-15(12-23(3,4)27-22)28(5)21-7-6-18(25-26-21)17-9-14-8-16(29)13-24-19(14)10-20(17)30/h6-10,13,15,27,29-30H,11-12H2,1-5H3.
What are the key properties of 6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol?
6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol has a molecular weight of 407.52 g/mol, XLogP of 3.85, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-3,7-diol is sourced from PubChem (CID 136607507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).