2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide

C17H11F3N6O3 — CID 164834383

IUPAC2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide
SMILESO=C(COc1ccc(-c2cnc3cnccn23)cn1)Nc1cc(C(F)(F)F)on1
InChIInChI=1S/C17H11F3N6O3/c18-17(19,20)12-5-13(25-29-12)24-15(27)9-28-16-2-1-10(6-23-16)11-7-22-14-8-21-3-4-26(11)14/h1-8H,9H2,(H,24,25,27)
InChIKeyQMXKNYSENBKSJS-UHFFFAOYSA-N
MW404.31 g/mol
LogP2.82
Rot. Bonds5

About 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide

2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide (PubChem CID 164834383) has the molecular formula C17H11F3N6O3 and a molecular weight of 404.31 g/mol. Its IUPAC name is 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide.

Molecular Properties

Compound Name2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide
PubChem CID164834383
Molecular FormulaC17H11F3N6O3
Molecular Weight404.31 g/mol
Exact Mass404.08
IUPAC Name2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide
SMILESO=C(COc1ccc(-c2cnc3cnccn23)cn1)Nc1cc(C(F)(F)F)on1
InChIInChI=1S/C17H11F3N6O3/c18-17(19,20)12-5-13(25-29-12)24-15(27)9-28-16-2-1-10(6-23-16)11-7-22-14-8-21-3-4-26(11)14/h1-8H,9H2,(H,24,25,27)
InChIKeyQMXKNYSENBKSJS-UHFFFAOYSA-N
XLogP2.82
TPSA107.44 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.31
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide?
The IUPAC name of 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide (CID 164834383) is 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide.
What is the SMILES notation for 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide?
The canonical SMILES for 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide is O=C(COc1ccc(-c2cnc3cnccn23)cn1)Nc1cc(C(F)(F)F)on1.
What is the InChIKey of 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide?
The InChIKey is QMXKNYSENBKSJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11F3N6O3/c18-17(19,20)12-5-13(25-29-12)24-15(27)9-28-16-2-1-10(6-23-16)11-7-22-14-8-21-3-4-26(11)14/h1-8H,9H2,(H,24,25,27).
What are the key properties of 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide?
2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide has a molecular weight of 404.31 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-N-[5-(trifluoromethyl)-1,2-oxazol-3-yl]acetamide is sourced from PubChem (CID 164834383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).