N-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide

C16H10F3N3O2 — CID 118862322

IUPACN-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide
SMILESO=C(Nc1cc(-c2cnco2)cc(C(F)(F)F)c1)c1ccccn1
InChIInChI=1S/C16H10F3N3O2/c17-16(18,19)11-5-10(14-8-20-9-24-14)6-12(7-11)22-15(23)13-3-1-2-4-21-13/h1-9H,(H,22,23)
InChIKeyIBFPMCZPSYESQZ-UHFFFAOYSA-N
MW333.27 g/mol
LogP4.01
Rot. Bonds3

About N-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide

N-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide (PubChem CID 118862322) has the molecular formula C16H10F3N3O2 and a molecular weight of 333.27 g/mol. Its IUPAC name is N-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide
PubChem CID118862322
Molecular FormulaC16H10F3N3O2
Molecular Weight333.27 g/mol
Exact Mass333.07
IUPAC NameN-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide
SMILESO=C(Nc1cc(-c2cnco2)cc(C(F)(F)F)c1)c1ccccn1
InChIInChI=1S/C16H10F3N3O2/c17-16(18,19)11-5-10(14-8-20-9-24-14)6-12(7-11)22-15(23)13-3-1-2-4-21-13/h1-9H,(H,22,23)
InChIKeyIBFPMCZPSYESQZ-UHFFFAOYSA-N
XLogP4.01
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.27
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
The IUPAC name of N-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide (CID 118862322) is N-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for N-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide is O=C(Nc1cc(-c2cnco2)cc(C(F)(F)F)c1)c1ccccn1.
What is the InChIKey of N-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
The InChIKey is IBFPMCZPSYESQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F3N3O2/c17-16(18,19)11-5-10(14-8-20-9-24-14)6-12(7-11)22-15(23)13-3-1-2-4-21-13/h1-9H,(H,22,23).
What are the key properties of N-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
N-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide has a molecular weight of 333.27 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1,3-oxazol-5-yl)-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 118862322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).