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

C18H12F2N2O2 — CID 86274511

IUPAC6-[2-fluoro-4-(4-fluorophenoxy)phenyl]pyridine-2-carboxamide
SMILESNC(=O)c1cccc(-c2ccc(Oc3ccc(F)cc3)cc2F)n1
InChIInChI=1S/C18H12F2N2O2/c19-11-4-6-12(7-5-11)24-13-8-9-14(15(20)10-13)16-2-1-3-17(22-16)18(21)23/h1-10H,(H2,21,23)
InChIKeyOKUDTJIVVAVAFN-UHFFFAOYSA-N
MW326.30 g/mol
LogP3.92
Rot. Bonds4

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

6-[2-fluoro-4-(4-fluorophenoxy)phenyl]pyridine-2-carboxamide (PubChem CID 86274511) has the molecular formula C18H12F2N2O2 and a molecular weight of 326.30 g/mol. Its IUPAC name is 6-[2-fluoro-4-(4-fluorophenoxy)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-[2-fluoro-4-(4-fluorophenoxy)phenyl]pyridine-2-carboxamide
PubChem CID86274511
Molecular FormulaC18H12F2N2O2
Molecular Weight326.30 g/mol
Exact Mass326.09
IUPAC Name6-[2-fluoro-4-(4-fluorophenoxy)phenyl]pyridine-2-carboxamide
SMILESNC(=O)c1cccc(-c2ccc(Oc3ccc(F)cc3)cc2F)n1
InChIInChI=1S/C18H12F2N2O2/c19-11-4-6-12(7-5-11)24-13-8-9-14(15(20)10-13)16-2-1-3-17(22-16)18(21)23/h1-10H,(H2,21,23)
InChIKeyOKUDTJIVVAVAFN-UHFFFAOYSA-N
XLogP3.92
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.30
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[2-fluoro-4-(4-fluorophenoxy)phenyl]pyridine-2-carboxamide?
The IUPAC name of 6-[2-fluoro-4-(4-fluorophenoxy)phenyl]pyridine-2-carboxamide (CID 86274511) is 6-[2-fluoro-4-(4-fluorophenoxy)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-[2-fluoro-4-(4-fluorophenoxy)phenyl]pyridine-2-carboxamide?
The canonical SMILES for 6-[2-fluoro-4-(4-fluorophenoxy)phenyl]pyridine-2-carboxamide is NC(=O)c1cccc(-c2ccc(Oc3ccc(F)cc3)cc2F)n1.
What is the InChIKey of 6-[2-fluoro-4-(4-fluorophenoxy)phenyl]pyridine-2-carboxamide?
The InChIKey is OKUDTJIVVAVAFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F2N2O2/c19-11-4-6-12(7-5-11)24-13-8-9-14(15(20)10-13)16-2-1-3-17(22-16)18(21)23/h1-10H,(H2,21,23).
What are the key properties of 6-[2-fluoro-4-(4-fluorophenoxy)phenyl]pyridine-2-carboxamide?
6-[2-fluoro-4-(4-fluorophenoxy)phenyl]pyridine-2-carboxamide has a molecular weight of 326.30 g/mol, XLogP of 3.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-fluoro-4-(4-fluorophenoxy)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 86274511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).