5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid

C14H13FN2O3 — CID 21081701

IUPAC5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid
SMILESCN(C)c1cc(C(=O)O)c(=O)n(-c2ccc(F)cc2)c1
InChIInChI=1S/C14H13FN2O3/c1-16(2)11-7-12(14(19)20)13(18)17(8-11)10-5-3-9(15)4-6-10/h3-8H,1-2H3,(H,19,20)
InChIKeyRALPAQCSUULHGB-UHFFFAOYSA-N
MW276.27 g/mol
LogP1.74
Rot. Bonds3

About 5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid

5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid (PubChem CID 21081701) has the molecular formula C14H13FN2O3 and a molecular weight of 276.27 g/mol. Its IUPAC name is 5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid
PubChem CID21081701
Molecular FormulaC14H13FN2O3
Molecular Weight276.27 g/mol
Exact Mass276.09
IUPAC Name5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid
SMILESCN(C)c1cc(C(=O)O)c(=O)n(-c2ccc(F)cc2)c1
InChIInChI=1S/C14H13FN2O3/c1-16(2)11-7-12(14(19)20)13(18)17(8-11)10-5-3-9(15)4-6-10/h3-8H,1-2H3,(H,19,20)
InChIKeyRALPAQCSUULHGB-UHFFFAOYSA-N
XLogP1.74
TPSA62.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.27
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid?
The IUPAC name of 5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid (CID 21081701) is 5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid.
What is the SMILES notation for 5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid?
The canonical SMILES for 5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid is CN(C)c1cc(C(=O)O)c(=O)n(-c2ccc(F)cc2)c1.
What is the InChIKey of 5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid?
The InChIKey is RALPAQCSUULHGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O3/c1-16(2)11-7-12(14(19)20)13(18)17(8-11)10-5-3-9(15)4-6-10/h3-8H,1-2H3,(H,19,20).
What are the key properties of 5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid?
5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid has a molecular weight of 276.27 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)-1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid is sourced from PubChem (CID 21081701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).