2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid

C19H11F2N3O2 — CID 118484953

IUPAC2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
SMILESO=C(O)c1ccnc2nc(-c3ccc(-c4ccccc4F)cc3F)[nH]c12
InChIInChI=1S/C19H11F2N3O2/c20-14-4-2-1-3-11(14)10-5-6-12(15(21)9-10)17-23-16-13(19(25)26)7-8-22-18(16)24-17/h1-9H,(H,25,26)(H,22,23,24)
InChIKeyPVTROVSTTLIQHC-UHFFFAOYSA-N
MW351.31 g/mol
LogP4.27
Rot. Bonds3

About 2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid

2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid (PubChem CID 118484953) has the molecular formula C19H11F2N3O2 and a molecular weight of 351.31 g/mol. Its IUPAC name is 2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid.

Molecular Properties

Compound Name2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
PubChem CID118484953
Molecular FormulaC19H11F2N3O2
Molecular Weight351.31 g/mol
Exact Mass351.08
IUPAC Name2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
SMILESO=C(O)c1ccnc2nc(-c3ccc(-c4ccccc4F)cc3F)[nH]c12
InChIInChI=1S/C19H11F2N3O2/c20-14-4-2-1-3-11(14)10-5-6-12(15(21)9-10)17-23-16-13(19(25)26)7-8-22-18(16)24-17/h1-9H,(H,25,26)(H,22,23,24)
InChIKeyPVTROVSTTLIQHC-UHFFFAOYSA-N
XLogP4.27
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.31
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid?
The IUPAC name of 2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid (CID 118484953) is 2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid.
What is the SMILES notation for 2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid?
The canonical SMILES for 2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid is O=C(O)c1ccnc2nc(-c3ccc(-c4ccccc4F)cc3F)[nH]c12.
What is the InChIKey of 2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid?
The InChIKey is PVTROVSTTLIQHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11F2N3O2/c20-14-4-2-1-3-11(14)10-5-6-12(15(21)9-10)17-23-16-13(19(25)26)7-8-22-18(16)24-17/h1-9H,(H,25,26)(H,22,23,24).
What are the key properties of 2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid?
2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid has a molecular weight of 351.31 g/mol, XLogP of 4.27, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid is sourced from PubChem (CID 118484953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).