N-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide

C16H10F3N3O2 — CID 162429835

IUPACN-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide
SMILESO=C(Nc1ncco1)c1ccnc(-c2ccc(C(F)(F)F)cc2)c1
InChIInChI=1S/C16H10F3N3O2/c17-16(18,19)12-3-1-10(2-4-12)13-9-11(5-6-20-13)14(23)22-15-21-7-8-24-15/h1-9H,(H,21,22,23)
InChIKeyLGLYQPQLAIOKGT-UHFFFAOYSA-N
MW333.27 g/mol
LogP4.01
Rot. Bonds3

About N-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide

N-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide (PubChem CID 162429835) has the molecular formula C16H10F3N3O2 and a molecular weight of 333.27 g/mol. Its IUPAC name is N-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide
PubChem CID162429835
Molecular FormulaC16H10F3N3O2
Molecular Weight333.27 g/mol
Exact Mass333.07
IUPAC NameN-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide
SMILESO=C(Nc1ncco1)c1ccnc(-c2ccc(C(F)(F)F)cc2)c1
InChIInChI=1S/C16H10F3N3O2/c17-16(18,19)12-3-1-10(2-4-12)13-9-11(5-6-20-13)14(23)22-15-21-7-8-24-15/h1-9H,(H,21,22,23)
InChIKeyLGLYQPQLAIOKGT-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

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Related Compounds

2-(3,4-dimethylphenyl)-N-(1,3-oxazol-2-yl)quinoline-4-carboxamide
CID 70789497
N-(1,3-oxazol-2-yl)-4-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide
CID 162429781
4-(3,5-difluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide
CID 162429785
N-(1,3-oxazol-2-yl)-4-[4-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 162429801
4-(3-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide
CID 162429811
4-(4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide
CID 162429815
4-(4-chlorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide
CID 162429817
N-(1,3-oxazol-2-yl)-4-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxamide
CID 162429828
4-(4-chloro-3-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide
CID 162429851
4-(3,4-difluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide
CID 162429854
4-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide
CID 162429859
2-(3,4-dichlorophenyl)-N-(1,3-oxazol-2-yl)pyridine-4-carboxamide
CID 162429860

Frequently Asked Questions

What is the IUPAC name of N-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide?
The IUPAC name of N-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide (CID 162429835) is N-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide.
What is the SMILES notation for N-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide?
The canonical SMILES for N-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide is O=C(Nc1ncco1)c1ccnc(-c2ccc(C(F)(F)F)cc2)c1.
What is the InChIKey of N-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide?
The InChIKey is LGLYQPQLAIOKGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F3N3O2/c17-16(18,19)12-3-1-10(2-4-12)13-9-11(5-6-20-13)14(23)22-15-21-7-8-24-15/h1-9H,(H,21,22,23).
What are the key properties of N-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide?
N-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-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-(1,3-oxazol-2-yl)-2-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 162429835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).