5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide

C16H10F2N2O4 — CID 23148992

IUPAC5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide
SMILESNC(=O)c1oc2c(O)cc(F)cc2c1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C16H10F2N2O4/c17-8-3-1-7(2-4-8)16(23)20-12-10-5-9(18)6-11(21)13(10)24-14(12)15(19)22/h1-6,21H,(H2,19,22)(H,20,23)
InChIKeyFOVGQYIZTQERCQ-UHFFFAOYSA-N
MW332.26 g/mol
LogP2.77
Rot. Bonds3

About 5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide

5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide (PubChem CID 23148992) has the molecular formula C16H10F2N2O4 and a molecular weight of 332.26 g/mol. Its IUPAC name is 5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide
PubChem CID23148992
Molecular FormulaC16H10F2N2O4
Molecular Weight332.26 g/mol
Exact Mass332.06
IUPAC Name5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide
SMILESNC(=O)c1oc2c(O)cc(F)cc2c1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C16H10F2N2O4/c17-8-3-1-7(2-4-8)16(23)20-12-10-5-9(18)6-11(21)13(10)24-14(12)15(19)22/h1-6,21H,(H2,19,22)(H,20,23)
InChIKeyFOVGQYIZTQERCQ-UHFFFAOYSA-N
XLogP2.77
TPSA105.56 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.26
LogP ≤ 52.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide 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-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide?
The IUPAC name of 5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide (CID 23148992) is 5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide.
What is the SMILES notation for 5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide?
The canonical SMILES for 5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide is NC(=O)c1oc2c(O)cc(F)cc2c1NC(=O)c1ccc(F)cc1.
What is the InChIKey of 5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide?
The InChIKey is FOVGQYIZTQERCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F2N2O4/c17-8-3-1-7(2-4-8)16(23)20-12-10-5-9(18)6-11(21)13(10)24-14(12)15(19)22/h1-6,21H,(H2,19,22)(H,20,23).
What are the key properties of 5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide?
5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide has a molecular weight of 332.26 g/mol, XLogP of 2.77, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-[(4-fluorobenzoyl)amino]-7-hydroxy-1-benzofuran-2-carboxamide is sourced from PubChem (CID 23148992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).