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

C24H30N6O2 — CID 136639493

IUPAC7-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
InChIInChI=1S/C24H30N6O2/c1-23(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/h6-11,15,29,31H,12-13H2,1-5H3,(H2,25,32)
InChIKeyVUQIMGRMLSRSQM-UHFFFAOYSA-N
MW434.54 g/mol
LogP3.24
Rot. Bonds4

About 7-hydroxy-6-[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 136639493) has the molecular formula C24H30N6O2 and a molecular weight of 434.54 g/mol. Its IUPAC name is 7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide.

Molecular Properties

Compound Name7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide
PubChem CID136639493
Molecular FormulaC24H30N6O2
Molecular Weight434.54 g/mol
Exact Mass434.24
IUPAC Name7-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
InChIInChI=1S/C24H30N6O2/c1-23(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/h6-11,15,29,31H,12-13H2,1-5H3,(H2,25,32)
InChIKeyVUQIMGRMLSRSQM-UHFFFAOYSA-N
XLogP3.24
TPSA117.26 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.54
LogP ≤ 53.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide?
The IUPAC name of 7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide (CID 136639493) is 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 7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide?
The canonical SMILES for 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.
What is the InChIKey of 7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide?
The InChIKey is VUQIMGRMLSRSQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N6O2/c1-23(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/h6-11,15,29,31H,12-13H2,1-5H3,(H2,25,32).
What are the key properties of 7-hydroxy-6-[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 434.54 g/mol, XLogP of 3.24, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinoline-2-carboxamide is sourced from PubChem (CID 136639493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).