N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide

C11H11F3N4O — CID 155213546

IUPACN-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
SMILESCCC(NC(=O)c1cccn2ncnc12)C(F)(F)F
InChIInChI=1S/C11H11F3N4O/c1-2-8(11(12,13)14)17-10(19)7-4-3-5-18-9(7)15-6-16-18/h3-6,8H,2H2,1H3,(H,17,19)
InChIKeyUYKAQRDGSARKCU-UHFFFAOYSA-N
MW272.23 g/mol
LogP1.80
Rot. Bonds3

About N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide

N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide (PubChem CID 155213546) has the molecular formula C11H11F3N4O and a molecular weight of 272.23 g/mol. Its IUPAC name is N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide.

Molecular Properties

Compound NameN-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
PubChem CID155213546
Molecular FormulaC11H11F3N4O
Molecular Weight272.23 g/mol
Exact Mass272.09
IUPAC NameN-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
SMILESCCC(NC(=O)c1cccn2ncnc12)C(F)(F)F
InChIInChI=1S/C11H11F3N4O/c1-2-8(11(12,13)14)17-10(19)7-4-3-5-18-9(7)15-6-16-18/h3-6,8H,2H2,1H3,(H,17,19)
InChIKeyUYKAQRDGSARKCU-UHFFFAOYSA-N
XLogP1.80
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.23
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide with MolForge

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Related Compounds

2,2,2-trifluoro-N-([1,2,4]triazolo[1,5-a]pyridin-8-yl)acetamide
CID 1475792
2-([1,2,4]triazolo[1,5-a]pyridin-8-yl)acetic acid
CID 82599293
2-amino-6-bromo-N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
CID 155231987
4,4,4-trifluoro-3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid
CID 138057760
4-(1-tert-butylpyrazol-4-yl)-N-(1,1,1-trifluorobutan-2-yl)pyridine-2-carboxamide
CID 171682647
ethyl 8-phenyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate
CID 102491621
7-chloro-1-(2-chloro-6-fluorophenyl)-4-oxo-N-(1,1,1-trifluorobutan-2-yl)-1,8-naphthyridine-3-carboxamide
CID 135354802
3-([1,2,4]triazolo[1,5-a]pyridin-8-yl)propanoic acid
CID 83829662
1-(2,6-difluorophenyl)-6-fluoro-7-[2-hydroxyethyl(methyl)amino]-4-oxo-N-(1,1,1-trifluorobutan-2-yl)-1,8-naphthyridine-3-carboxamide
CID 134360166
N-[1-(1-adamantyl)propyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19414537
2-thiophen-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-8-yl)acetamide
CID 53190524
N-[(1R)-1-(4-phenylphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 52534736

Frequently Asked Questions

What is the IUPAC name of N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The IUPAC name of N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide (CID 155213546) is N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide.
What is the SMILES notation for N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The canonical SMILES for N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide is CCC(NC(=O)c1cccn2ncnc12)C(F)(F)F.
What is the InChIKey of N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The InChIKey is UYKAQRDGSARKCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N4O/c1-2-8(11(12,13)14)17-10(19)7-4-3-5-18-9(7)15-6-16-18/h3-6,8H,2H2,1H3,(H,17,19).
What are the key properties of N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide has a molecular weight of 272.23 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,1,1-trifluorobutan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide is sourced from PubChem (CID 155213546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).