N-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide

C13H10F3N3O2 — CID 86280745

IUPACN-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide
SMILESO=C(Nc1cc(C(F)(F)F)cc(-c2cnco2)n1)C1CC1
InChIInChI=1S/C13H10F3N3O2/c14-13(15,16)8-3-9(10-5-17-6-21-10)18-11(4-8)19-12(20)7-1-2-7/h3-7H,1-2H2,(H,18,19,20)
InChIKeyZFIYGIJALJMZIZ-UHFFFAOYSA-N
MW297.24 g/mol
LogP3.10
Rot. Bonds3

About N-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide

N-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide (PubChem CID 86280745) has the molecular formula C13H10F3N3O2 and a molecular weight of 297.24 g/mol. Its IUPAC name is N-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide
PubChem CID86280745
Molecular FormulaC13H10F3N3O2
Molecular Weight297.24 g/mol
Exact Mass297.07
IUPAC NameN-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide
SMILESO=C(Nc1cc(C(F)(F)F)cc(-c2cnco2)n1)C1CC1
InChIInChI=1S/C13H10F3N3O2/c14-13(15,16)8-3-9(10-5-17-6-21-10)18-11(4-8)19-12(20)7-1-2-7/h3-7H,1-2H2,(H,18,19,20)
InChIKeyZFIYGIJALJMZIZ-UHFFFAOYSA-N
XLogP3.10
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.24
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide?
The IUPAC name of N-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide (CID 86280745) is N-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide?
The canonical SMILES for N-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide is O=C(Nc1cc(C(F)(F)F)cc(-c2cnco2)n1)C1CC1.
What is the InChIKey of N-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide?
The InChIKey is ZFIYGIJALJMZIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3N3O2/c14-13(15,16)8-3-9(10-5-17-6-21-10)18-11(4-8)19-12(20)7-1-2-7/h3-7H,1-2H2,(H,18,19,20).
What are the key properties of N-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide?
N-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide has a molecular weight of 297.24 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]cyclopropanecarboxamide is sourced from PubChem (CID 86280745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).