N-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide

C12H8F2N2O2 — CID 110863623

IUPACN-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1cc(=O)cc[nH]1
InChIInChI=1S/C12H8F2N2O2/c13-7-1-2-10(9(14)5-7)16-12(18)11-6-8(17)3-4-15-11/h1-6H,(H,15,17)(H,16,18)
InChIKeyPRIUOMZDGRZDLX-UHFFFAOYSA-N
MW250.20 g/mol
LogP1.91
Rot. Bonds2

About N-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide

N-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide (PubChem CID 110863623) has the molecular formula C12H8F2N2O2 and a molecular weight of 250.20 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide
PubChem CID110863623
Molecular FormulaC12H8F2N2O2
Molecular Weight250.20 g/mol
Exact Mass250.06
IUPAC NameN-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1cc(=O)cc[nH]1
InChIInChI=1S/C12H8F2N2O2/c13-7-1-2-10(9(14)5-7)16-12(18)11-6-8(17)3-4-15-11/h1-6H,(H,15,17)(H,16,18)
InChIKeyPRIUOMZDGRZDLX-UHFFFAOYSA-N
XLogP1.91
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.20
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide (CID 110863623) is N-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide is O=C(Nc1ccc(F)cc1F)c1cc(=O)cc[nH]1.
What is the InChIKey of N-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide?
The InChIKey is PRIUOMZDGRZDLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8F2N2O2/c13-7-1-2-10(9(14)5-7)16-12(18)11-6-8(17)3-4-15-11/h1-6H,(H,15,17)(H,16,18).
What are the key properties of N-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide?
N-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide has a molecular weight of 250.20 g/mol, XLogP of 1.91, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-4-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 110863623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).