6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine

C15H11F3N4O — CID 118862321

IUPAC6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine
SMILESFC(F)(F)c1cc(NCc2ccccn2)nc(-c2cnco2)c1
InChIInChI=1S/C15H11F3N4O/c16-15(17,18)10-5-12(13-8-19-9-23-13)22-14(6-10)21-7-11-3-1-2-4-20-11/h1-6,8-9H,7H2,(H,21,22)
InChIKeyGPHFEVZUORBJNR-UHFFFAOYSA-N
MW320.27 g/mol
LogP3.76
Rot. Bonds4

About 6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine

6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 118862321) has the molecular formula C15H11F3N4O and a molecular weight of 320.27 g/mol. Its IUPAC name is 6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine
PubChem CID118862321
Molecular FormulaC15H11F3N4O
Molecular Weight320.27 g/mol
Exact Mass320.09
IUPAC Name6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine
SMILESFC(F)(F)c1cc(NCc2ccccn2)nc(-c2cnco2)c1
InChIInChI=1S/C15H11F3N4O/c16-15(17,18)10-5-12(13-8-19-9-23-13)22-14(6-10)21-7-11-3-1-2-4-20-11/h1-6,8-9H,7H2,(H,21,22)
InChIKeyGPHFEVZUORBJNR-UHFFFAOYSA-N
XLogP3.76
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.27
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine (CID 118862321) is 6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine is FC(F)(F)c1cc(NCc2ccccn2)nc(-c2cnco2)c1.
What is the InChIKey of 6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is GPHFEVZUORBJNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F3N4O/c16-15(17,18)10-5-12(13-8-19-9-23-13)22-14(6-10)21-7-11-3-1-2-4-20-11/h1-6,8-9H,7H2,(H,21,22).
What are the key properties of 6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine?
6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 320.27 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1,3-oxazol-5-yl)-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 118862321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).