5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide

C14H8F6N2O2 — CID 1478755

IUPAC5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide
SMILESNC(=O)c1ncc(C(F)(F)F)cc1Oc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C14H8F6N2O2/c15-13(16,17)7-1-3-9(4-2-7)24-10-5-8(14(18,19)20)6-22-11(10)12(21)23/h1-6H,(H2,21,23)
InChIKeyKYIHLUUBKXJLFL-UHFFFAOYSA-N
MW350.22 g/mol
LogP4.01
Rot. Bonds3

About 5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide

5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide (PubChem CID 1478755) has the molecular formula C14H8F6N2O2 and a molecular weight of 350.22 g/mol. Its IUPAC name is 5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide
PubChem CID1478755
Molecular FormulaC14H8F6N2O2
Molecular Weight350.22 g/mol
Exact Mass350.05
IUPAC Name5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide
SMILESNC(=O)c1ncc(C(F)(F)F)cc1Oc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C14H8F6N2O2/c15-13(16,17)7-1-3-9(4-2-7)24-10-5-8(14(18,19)20)6-22-11(10)12(21)23/h1-6H,(H2,21,23)
InChIKeyKYIHLUUBKXJLFL-UHFFFAOYSA-N
XLogP4.01
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.22
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide?
The IUPAC name of 5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide (CID 1478755) is 5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide.
What is the SMILES notation for 5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide?
The canonical SMILES for 5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide is NC(=O)c1ncc(C(F)(F)F)cc1Oc1ccc(C(F)(F)F)cc1.
What is the InChIKey of 5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide?
The InChIKey is KYIHLUUBKXJLFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8F6N2O2/c15-13(16,17)7-1-3-9(4-2-7)24-10-5-8(14(18,19)20)6-22-11(10)12(21)23/h1-6H,(H2,21,23).
What are the key properties of 5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide?
5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide has a molecular weight of 350.22 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxamide is sourced from PubChem (CID 1478755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).