6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one

C18H17FN4O — CID 133368386

IUPAC6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
SMILESCc1cc(N2CCc3nn(C)c(=O)cc3C2)c2cc(F)ccc2n1
InChIInChI=1S/C18H17FN4O/c1-11-7-17(14-9-13(19)3-4-16(14)20-11)23-6-5-15-12(10-23)8-18(24)22(2)21-15/h3-4,7-9H,5-6,10H2,1-2H3
InChIKeyUADOJRMBYOEBHT-UHFFFAOYSA-N
MW324.36 g/mol
LogP2.34
Rot. Bonds1

About 6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one

6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one (PubChem CID 133368386) has the molecular formula C18H17FN4O and a molecular weight of 324.36 g/mol. Its IUPAC name is 6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one.

Molecular Properties

Compound Name6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
PubChem CID133368386
Molecular FormulaC18H17FN4O
Molecular Weight324.36 g/mol
Exact Mass324.14
IUPAC Name6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
SMILESCc1cc(N2CCc3nn(C)c(=O)cc3C2)c2cc(F)ccc2n1
InChIInChI=1S/C18H17FN4O/c1-11-7-17(14-9-13(19)3-4-16(14)20-11)23-6-5-15-12(10-23)8-18(24)22(2)21-15/h3-4,7-9H,5-6,10H2,1-2H3
InChIKeyUADOJRMBYOEBHT-UHFFFAOYSA-N
XLogP2.34
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.36
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one with MolForge

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Related Compounds

6-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 71971635
6-fluoro-2-methyl-4-[4-(2-methylpyrimidin-4-yl)piperazin-1-yl]quinoline
CID 133458892
5-[4-(6-fluoro-2-methylquinolin-4-yl)piperazin-1-yl]-3-methyl-1,2,4-thiadiazole
CID 133368174
6-fluoro-2-methyl-4-[4-(1,1,1-trifluoropropan-2-yl)piperazin-1-yl]quinoline
CID 133368681
4-(6-fluoro-2-methylquinolin-4-yl)-2-(furan-2-yl)morpholine
CID 133368875
6-[2-(2,4-difluorophenyl)-2-hydroxyethyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 111469783
6-(5-bromo-4-methyl-2-pyridinyl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 133403629
4-[3-(2,5-dihydropyrrol-1-yl)pyrrolidin-1-yl]-6-fluoro-2-methylquinoline
CID 133368181
6-fluoro-2-methyl-4-[4-(2-pyrrolidin-1-ylethoxy)piperidin-1-yl]quinoline
CID 133368472
4-(6-amino-2-methylquinolin-4-yl)-1-methyl-1,4-diazepan-2-one
CID 102888389
6-fluoro-2-methyl-4-[3-(2-methylpropoxy)pyrrolidin-1-yl]quinoline
CID 133369112
4-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylquinoline-7-carboxylic acid
CID 7138050

Frequently Asked Questions

What is the IUPAC name of 6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one?
The IUPAC name of 6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one (CID 133368386) is 6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one.
What is the SMILES notation for 6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one?
The canonical SMILES for 6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one is Cc1cc(N2CCc3nn(C)c(=O)cc3C2)c2cc(F)ccc2n1.
What is the InChIKey of 6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one?
The InChIKey is UADOJRMBYOEBHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN4O/c1-11-7-17(14-9-13(19)3-4-16(14)20-11)23-6-5-15-12(10-23)8-18(24)22(2)21-15/h3-4,7-9H,5-6,10H2,1-2H3.
What are the key properties of 6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one?
6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one has a molecular weight of 324.36 g/mol, XLogP of 2.34, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-fluoro-2-methylquinolin-4-yl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one is sourced from PubChem (CID 133368386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).