6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide

C19H12F4N2O2 — CID 86274276

IUPAC6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
SMILESNC(=O)c1cccc(-c2ccc(Oc3ccc(F)cc3)cc2C(F)(F)F)n1
InChIInChI=1S/C19H12F4N2O2/c20-11-4-6-12(7-5-11)27-13-8-9-14(15(10-13)19(21,22)23)16-2-1-3-17(25-16)18(24)26/h1-10H,(H2,24,26)
InChIKeyJBDVGERYWCKRAN-UHFFFAOYSA-N
MW376.31 g/mol
LogP4.80
Rot. Bonds4

About 6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide

6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide (PubChem CID 86274276) has the molecular formula C19H12F4N2O2 and a molecular weight of 376.31 g/mol. Its IUPAC name is 6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
PubChem CID86274276
Molecular FormulaC19H12F4N2O2
Molecular Weight376.31 g/mol
Exact Mass376.08
IUPAC Name6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
SMILESNC(=O)c1cccc(-c2ccc(Oc3ccc(F)cc3)cc2C(F)(F)F)n1
InChIInChI=1S/C19H12F4N2O2/c20-11-4-6-12(7-5-11)27-13-8-9-14(15(10-13)19(21,22)23)16-2-1-3-17(25-16)18(24)26/h1-10H,(H2,24,26)
InChIKeyJBDVGERYWCKRAN-UHFFFAOYSA-N
XLogP4.80
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.31
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
The IUPAC name of 6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide (CID 86274276) is 6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for 6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide is NC(=O)c1cccc(-c2ccc(Oc3ccc(F)cc3)cc2C(F)(F)F)n1.
What is the InChIKey of 6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
The InChIKey is JBDVGERYWCKRAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F4N2O2/c20-11-4-6-12(7-5-11)27-13-8-9-14(15(10-13)19(21,22)23)16-2-1-3-17(25-16)18(24)26/h1-10H,(H2,24,26).
What are the key properties of 6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide has a molecular weight of 376.31 g/mol, XLogP of 4.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(4-fluorophenoxy)-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 86274276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).