N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide

C18H17FN8O — CID 170340705

IUPACN-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide
SMILESCc1nc2c(C)cc(-c3cc(F)c4nc(NC(=O)C5CNC5)cn4c3)nn2n1
InChIInChI=1S/C18H17FN8O/c1-9-3-14(25-27-16(9)21-10(2)24-27)11-4-13(19)17-22-15(8-26(17)7-11)23-18(28)12-5-20-6-12/h3-4,7-8,12,20H,5-6H2,1-2H3,(H,23,28)
InChIKeyFXUUGEOCELUPQX-UHFFFAOYSA-N
MW380.39 g/mol
LogP1.35
Rot. Bonds3

About N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide

N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide (PubChem CID 170340705) has the molecular formula C18H17FN8O and a molecular weight of 380.39 g/mol. Its IUPAC name is N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide.

Molecular Properties

Compound NameN-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide
PubChem CID170340705
Molecular FormulaC18H17FN8O
Molecular Weight380.39 g/mol
Exact Mass380.15
IUPAC NameN-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide
SMILESCc1nc2c(C)cc(-c3cc(F)c4nc(NC(=O)C5CNC5)cn4c3)nn2n1
InChIInChI=1S/C18H17FN8O/c1-9-3-14(25-27-16(9)21-10(2)24-27)11-4-13(19)17-22-15(8-26(17)7-11)23-18(28)12-5-20-6-12/h3-4,7-8,12,20H,5-6H2,1-2H3,(H,23,28)
InChIKeyFXUUGEOCELUPQX-UHFFFAOYSA-N
XLogP1.35
TPSA101.51 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.39
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide with MolForge

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Related Compounds

N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]-1-ethylazetidine-3-carboxamide
CID 170593655
N-[6-[8-(difluoromethyl)-2-methyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]-1-ethylazetidine-3-carboxamide
CID 170594058
N-[6-[8-(difluoromethyl)-2-methyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]formamide
CID 170593508
N-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]formamide
CID 170593703
6-(8-fluoro-2-pyrrolidin-3-ylimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170593872
6-(2-cyclopropyl-8-methoxyimidazo[1,2-a]pyridin-6-yl)-2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazine
CID 170593579
N'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine
CID 170593804
6-(2-cyclopropyl-8-methoxyimidazo[1,2-a]pyridin-6-yl)-2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazine;N,N-dimethylmethanamine
CID 177038472
6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoro-N-[[(2R)-piperidin-2-yl]methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 170340784
N-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide
CID 154686347
6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170340773
tert-butyl (2R)-2-[[[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridine-2-carbonyl]amino]methyl]piperidine-1-carboxylate
CID 170593491

Frequently Asked Questions

What is the IUPAC name of N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide?
The IUPAC name of N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide (CID 170340705) is N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide.
What is the SMILES notation for N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide?
The canonical SMILES for N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide is Cc1nc2c(C)cc(-c3cc(F)c4nc(NC(=O)C5CNC5)cn4c3)nn2n1.
What is the InChIKey of N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide?
The InChIKey is FXUUGEOCELUPQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN8O/c1-9-3-14(25-27-16(9)21-10(2)24-27)11-4-13(19)17-22-15(8-26(17)7-11)23-18(28)12-5-20-6-12/h3-4,7-8,12,20H,5-6H2,1-2H3,(H,23,28).
What are the key properties of N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide?
N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide has a molecular weight of 380.39 g/mol, XLogP of 1.35, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2,8-dimethyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]azetidine-3-carboxamide is sourced from PubChem (CID 170340705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).