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

C15H10F3N7O — CID 170593508

IUPACN-[6-[8-(difluoromethyl)-2-methyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]formamide
SMILESCc1nc2c(C(F)F)cc(-c3cc(F)c4nc(NC=O)cn4c3)nn2n1
InChIInChI=1S/C15H10F3N7O/c1-7-20-14-9(13(17)18)3-11(23-25(14)22-7)8-2-10(16)15-21-12(19-6-26)5-24(15)4-8/h2-6,13H,1H3,(H,19,26)
InChIKeyNYCBFNRFZPOFLE-UHFFFAOYSA-N
MW361.29 g/mol
LogP2.39
Rot. Bonds4

About 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

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 (PubChem CID 170593508) has the molecular formula C15H10F3N7O and a molecular weight of 361.29 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound NameN-[6-[8-(difluoromethyl)-2-methyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]formamide
PubChem CID170593508
Molecular FormulaC15H10F3N7O
Molecular Weight361.29 g/mol
Exact Mass361.09
IUPAC NameN-[6-[8-(difluoromethyl)-2-methyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]formamide
SMILESCc1nc2c(C(F)F)cc(-c3cc(F)c4nc(NC=O)cn4c3)nn2n1
InChIInChI=1S/C15H10F3N7O/c1-7-20-14-9(13(17)18)3-11(23-25(14)22-7)8-2-10(16)15-21-12(19-6-26)5-24(15)4-8/h2-6,13H,1H3,(H,19,26)
InChIKeyNYCBFNRFZPOFLE-UHFFFAOYSA-N
XLogP2.39
TPSA89.48 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.29
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

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-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]formamide
CID 170593703
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
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
6-chloro-8-(difluoromethyl)-2-methyl-[1,2,4]triazolo[1,5-b]pyridazine
CID 177038346
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
[8-(difluoromethyl)-2-methyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl]boronic acid
CID 177038417
cyclopropane;N-[6-(4-fluoro-2,6-dimethylphenyl)imidazo[1,2-a]pyridin-2-yl]formamide
CID 154686461
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-(1,2-dimethylimidazol-4-yl)formamide
CID 168980267
N-[6-(2,6-dimethylphenyl)imidazo[1,2-a]pyridin-2-yl]formamide
CID 154686285
N-[8-amino-6-[5-chloro-6-fluoro-7-(propan-2-ylamino)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide;cyclopropane
CID 163221477

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is Cc1nc2c(C(F)F)cc(-c3cc(F)c4nc(NC=O)cn4c3)nn2n1.
What is the InChIKey of 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?
The InChIKey is NYCBFNRFZPOFLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F3N7O/c1-7-20-14-9(13(17)18)3-11(23-25(14)22-7)8-2-10(16)15-21-12(19-6-26)5-24(15)4-8/h2-6,13H,1H3,(H,19,26).
What are the key properties of 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?
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 has a molecular weight of 361.29 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 170593508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).