1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide

C23H15F2N3O3 — CID 141340950

IUPAC1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide
SMILESO=C(Nc1ccc(Oc2ccncc2)c(F)c1)c1cccn(-c2ccc(F)cc2)c1=O
InChIInChI=1S/C23H15F2N3O3/c24-15-3-6-17(7-4-15)28-13-1-2-19(23(28)30)22(29)27-16-5-8-21(20(25)14-16)31-18-9-11-26-12-10-18/h1-14H,(H,27,29)
InChIKeyXFXAMCQJMNCCHZ-UHFFFAOYSA-N
MW419.39 g/mol
LogP4.56
Rot. Bonds5

About 1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide

1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide (PubChem CID 141340950) has the molecular formula C23H15F2N3O3 and a molecular weight of 419.39 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide
PubChem CID141340950
Molecular FormulaC23H15F2N3O3
Molecular Weight419.39 g/mol
Exact Mass419.11
IUPAC Name1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide
SMILESO=C(Nc1ccc(Oc2ccncc2)c(F)c1)c1cccn(-c2ccc(F)cc2)c1=O
InChIInChI=1S/C23H15F2N3O3/c24-15-3-6-17(7-4-15)28-13-1-2-19(23(28)30)22(29)27-16-5-8-21(20(25)14-16)31-18-9-11-26-12-10-18/h1-14H,(H,27,29)
InChIKeyXFXAMCQJMNCCHZ-UHFFFAOYSA-N
XLogP4.56
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.39
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide (CID 141340950) is 1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide is O=C(Nc1ccc(Oc2ccncc2)c(F)c1)c1cccn(-c2ccc(F)cc2)c1=O.
What is the InChIKey of 1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide?
The InChIKey is XFXAMCQJMNCCHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15F2N3O3/c24-15-3-6-17(7-4-15)28-13-1-2-19(23(28)30)22(29)27-16-5-8-21(20(25)14-16)31-18-9-11-26-12-10-18/h1-14H,(H,27,29).
What are the key properties of 1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide?
1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide has a molecular weight of 419.39 g/mol, XLogP of 4.56, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-(3-fluoro-4-pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 141340950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).