4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid

C14H9FN2O2S — CID 53325886

IUPAC4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid
SMILESO=C(O)c1cc2sccc2c(Nc2ccc(F)cc2)n1
InChIInChI=1S/C14H9FN2O2S/c15-8-1-3-9(4-2-8)16-13-10-5-6-20-12(10)7-11(17-13)14(18)19/h1-7H,(H,16,17)(H,18,19)
InChIKeyKSOFDWOLRDUOPR-UHFFFAOYSA-N
MW288.30 g/mol
LogP3.88
Rot. Bonds3

About 4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid

4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid (PubChem CID 53325886) has the molecular formula C14H9FN2O2S and a molecular weight of 288.30 g/mol. Its IUPAC name is 4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid
PubChem CID53325886
Molecular FormulaC14H9FN2O2S
Molecular Weight288.30 g/mol
Exact Mass288.04
IUPAC Name4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid
SMILESO=C(O)c1cc2sccc2c(Nc2ccc(F)cc2)n1
InChIInChI=1S/C14H9FN2O2S/c15-8-1-3-9(4-2-8)16-13-10-5-6-20-12(10)7-11(17-13)14(18)19/h1-7H,(H,16,17)(H,18,19)
InChIKeyKSOFDWOLRDUOPR-UHFFFAOYSA-N
XLogP3.88
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.30
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-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

Related Compounds

4-(3-Hydroxypropylamino)thieno[3,2-c]quinoline-7-carboxylic acid
CID 50941855
4-(3-Chloroanilino)thieno[3,2-c]pyridine-6-carboxylic acid
CID 53316657
4-Anilinothieno[3,2-c]pyridine-6-carboxylic acid
CID 53317960
4-[3-(Methylcarbamoyl)anilino]thieno[3,2-c]pyridine-6-carboxylic acid
CID 53317962
4-[2-(Dimethylamino)ethylamino]thieno[3,2-c]pyridine-6-carboxylic acid
CID 53320598
4-(2-Methylanilino)thieno[3,2-c]pyridine-6-carboxylic acid
CID 53320599
4-(3-Methoxyanilino)thieno[3,2-c]pyridine-6-carboxylic acid
CID 53321671
4-(3-Fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid
CID 53323250
4-(3-Ethynylanilino)thieno[3,2-c]pyridine-6-carboxylic acid
CID 53323251
4-(4-Chloroanilino)thieno[3,2-c]pyridine-6-carboxylic acid
CID 53324596
4-(2-Phenylethylamino)thieno[3,2-c]pyridine-6-carboxylic acid
CID 53325334
4-(3-Phenoxyanilino)thieno[3,2-c]pyridine-6-carboxylic acid
CID 53325887

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid?
The IUPAC name of 4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid (CID 53325886) is 4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid.
What is the SMILES notation for 4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid?
The canonical SMILES for 4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid is O=C(O)c1cc2sccc2c(Nc2ccc(F)cc2)n1.
What is the InChIKey of 4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid?
The InChIKey is KSOFDWOLRDUOPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9FN2O2S/c15-8-1-3-9(4-2-8)16-13-10-5-6-20-12(10)7-11(17-13)14(18)19/h1-7H,(H,16,17)(H,18,19).
What are the key properties of 4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid?
4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid has a molecular weight of 288.30 g/mol, XLogP of 3.88, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluoroanilino)thieno[3,2-c]pyridine-6-carboxylic acid is sourced from PubChem (CID 53325886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).