5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one

C17H12F2N2O — CID 156717159

IUPAC5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one
SMILESO=c1[nH]cc(Nc2ccccc2)cc1-c1ccc(F)cc1F
InChIInChI=1S/C17H12F2N2O/c18-11-6-7-14(16(19)8-11)15-9-13(10-20-17(15)22)21-12-4-2-1-3-5-12/h1-10,21H,(H,20,22)
InChIKeyYLCVNGFQDXGEOM-UHFFFAOYSA-N
MW298.29 g/mol
LogP4.06
Rot. Bonds3

About 5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one

5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one (PubChem CID 156717159) has the molecular formula C17H12F2N2O and a molecular weight of 298.29 g/mol. Its IUPAC name is 5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one
PubChem CID156717159
Molecular FormulaC17H12F2N2O
Molecular Weight298.29 g/mol
Exact Mass298.09
IUPAC Name5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one
SMILESO=c1[nH]cc(Nc2ccccc2)cc1-c1ccc(F)cc1F
InChIInChI=1S/C17H12F2N2O/c18-11-6-7-14(16(19)8-11)15-9-13(10-20-17(15)22)21-12-4-2-1-3-5-12/h1-10,21H,(H,20,22)
InChIKeyYLCVNGFQDXGEOM-UHFFFAOYSA-N
XLogP4.06
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.29
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one?
The IUPAC name of 5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one (CID 156717159) is 5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one.
What is the SMILES notation for 5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one?
The canonical SMILES for 5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one is O=c1[nH]cc(Nc2ccccc2)cc1-c1ccc(F)cc1F.
What is the InChIKey of 5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one?
The InChIKey is YLCVNGFQDXGEOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12F2N2O/c18-11-6-7-14(16(19)8-11)15-9-13(10-20-17(15)22)21-12-4-2-1-3-5-12/h1-10,21H,(H,20,22).
What are the key properties of 5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one?
5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one has a molecular weight of 298.29 g/mol, XLogP of 4.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-anilino-3-(2,4-difluorophenyl)-1H-pyridin-2-one is sourced from PubChem (CID 156717159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).