N-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide

C11H10F3N3O2 — CID 121371061

IUPACN-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide
SMILESCC(=O)NCc1c(C(F)(F)F)cc2cc[nH]n2c1=O
InChIInChI=1S/C11H10F3N3O2/c1-6(18)15-5-8-9(11(12,13)14)4-7-2-3-16-17(7)10(8)19/h2-4,16H,5H2,1H3,(H,15,18)
InChIKeyOJDYTKXJXBPBJK-UHFFFAOYSA-N
MW273.21 g/mol
LogP1.28
Rot. Bonds2

About N-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide

N-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide (PubChem CID 121371061) has the molecular formula C11H10F3N3O2 and a molecular weight of 273.21 g/mol. Its IUPAC name is N-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide
PubChem CID121371061
Molecular FormulaC11H10F3N3O2
Molecular Weight273.21 g/mol
Exact Mass273.07
IUPAC NameN-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide
SMILESCC(=O)NCc1c(C(F)(F)F)cc2cc[nH]n2c1=O
InChIInChI=1S/C11H10F3N3O2/c1-6(18)15-5-8-9(11(12,13)14)4-7-2-3-16-17(7)10(8)19/h2-4,16H,5H2,1H3,(H,15,18)
InChIKeyOJDYTKXJXBPBJK-UHFFFAOYSA-N
XLogP1.28
TPSA66.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.21
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide?
The IUPAC name of N-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide (CID 121371061) is N-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide.
What is the SMILES notation for N-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide?
The canonical SMILES for N-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide is CC(=O)NCc1c(C(F)(F)F)cc2cc[nH]n2c1=O.
What is the InChIKey of N-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide?
The InChIKey is OJDYTKXJXBPBJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3N3O2/c1-6(18)15-5-8-9(11(12,13)14)4-7-2-3-16-17(7)10(8)19/h2-4,16H,5H2,1H3,(H,15,18).
What are the key properties of N-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide?
N-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide has a molecular weight of 273.21 g/mol, XLogP of 1.28, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[7-oxo-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyridin-6-yl]methyl]acetamide is sourced from PubChem (CID 121371061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).