7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one

C24H31N5O2 — CID 136607532

IUPAC7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one
SMILESCN(c1ccc(-c2cc3ccc(=O)n(C)c3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C24H31N5O2/c1-23(2)13-16(14-24(3,4)27-23)28(5)21-9-8-18(25-26-21)17-11-15-7-10-22(31)29(6)19(15)12-20(17)30/h7-12,16,27,30H,13-14H2,1-6H3
InChIKeyBPWKBWPEQGLJFW-UHFFFAOYSA-N
MW421.55 g/mol
LogP3.45
Rot. Bonds3

About 7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one

7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one (PubChem CID 136607532) has the molecular formula C24H31N5O2 and a molecular weight of 421.55 g/mol. Its IUPAC name is 7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one.

Molecular Properties

Compound Name7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one
PubChem CID136607532
Molecular FormulaC24H31N5O2
Molecular Weight421.55 g/mol
Exact Mass421.25
IUPAC Name7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one
SMILESCN(c1ccc(-c2cc3ccc(=O)n(C)c3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C24H31N5O2/c1-23(2)13-16(14-24(3,4)27-23)28(5)21-9-8-18(25-26-21)17-11-15-7-10-22(31)29(6)19(15)12-20(17)30/h7-12,16,27,30H,13-14H2,1-6H3
InChIKeyBPWKBWPEQGLJFW-UHFFFAOYSA-N
XLogP3.45
TPSA83.28 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.55
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one with MolForge

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Related Compounds

4-[3-fluoro-5-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]-1H-pyridin-2-one
CID 136377171
4-[3-Fluoro-5-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]-1-methylpyridin-2-one
CID 136598231
2-[6-[Methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(trifluoromethyl)phenol
CID 136598267
5-[3-Fluoro-5-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]-1-methylpyridin-2-one
CID 136633748
5-[3-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]-3-(trifluoromethyl)-1H-pyridin-2-one
CID 136633749
2-[6-[Methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-4-(trifluoromethyl)phenol;hydrochloride
CID 137197128
4-[(Z)-1-amino-3-iminoprop-1-enyl]-5-fluoro-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol
CID 137227495
5-[4-[6-[2-fluoroethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-hydroxyphenyl]-1H-pyridin-2-one
CID 137464812
5-[4-[6-[2-fluoroethyl-(1,2,2,3-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-hydroxyphenyl]-1H-pyridin-2-one
CID 137465087
(E)-3-[2-fluoro-5-hydroxy-4-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenyl]-N-methylprop-2-enamide
CID 146173139
(E)-3-[4-[6-(4-aminopiperidin-1-yl)pyridazin-3-yl]-2-fluoro-5-hydroxyphenyl]-N-methylprop-2-enamide
CID 146173264
5-[4-[6-[2-fluoroethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-3-hydroxyphenyl]-3,4-dihydro-1H-pyrimidin-2-one
CID 155423112

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one?
The IUPAC name of 7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one (CID 136607532) is 7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one.
What is the SMILES notation for 7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one?
The canonical SMILES for 7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one is CN(c1ccc(-c2cc3ccc(=O)n(C)c3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one?
The InChIKey is BPWKBWPEQGLJFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N5O2/c1-23(2)13-16(14-24(3,4)27-23)28(5)21-9-8-18(25-26-21)17-11-15-7-10-22(31)29(6)19(15)12-20(17)30/h7-12,16,27,30H,13-14H2,1-6H3.
What are the key properties of 7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one?
7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one has a molecular weight of 421.55 g/mol, XLogP of 3.45, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-1-methyl-6-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]quinolin-2-one is sourced from PubChem (CID 136607532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).