[4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone

C25H16FN3O — CID 23025894

IUPAC[4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone
SMILESO=C(c1ccccc1)c1ccc(-c2nc3ncc(-c4ccccc4F)cc3[nH]2)cc1
InChIInChI=1S/C25H16FN3O/c26-21-9-5-4-8-20(21)19-14-22-25(27-15-19)29-24(28-22)18-12-10-17(11-13-18)23(30)16-6-2-1-3-7-16/h1-15H,(H,27,28,29)
InChIKeyXVGDFFXKGJWLTE-UHFFFAOYSA-N
MW393.42 g/mol
LogP5.66
Rot. Bonds4

About [4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone

[4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone (PubChem CID 23025894) has the molecular formula C25H16FN3O and a molecular weight of 393.42 g/mol. Its IUPAC name is [4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone.

Molecular Properties

Compound Name[4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone
PubChem CID23025894
Molecular FormulaC25H16FN3O
Molecular Weight393.42 g/mol
Exact Mass393.13
IUPAC Name[4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone
SMILESO=C(c1ccccc1)c1ccc(-c2nc3ncc(-c4ccccc4F)cc3[nH]2)cc1
InChIInChI=1S/C25H16FN3O/c26-21-9-5-4-8-20(21)19-14-22-25(27-15-19)29-24(28-22)18-12-10-17(11-13-18)23(30)16-6-2-1-3-7-16/h1-15H,(H,27,28,29)
InChIKeyXVGDFFXKGJWLTE-UHFFFAOYSA-N
XLogP5.66
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.42
LogP ≤ 55.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone?
The IUPAC name of [4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone (CID 23025894) is [4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone.
What is the SMILES notation for [4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone?
The canonical SMILES for [4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone is O=C(c1ccccc1)c1ccc(-c2nc3ncc(-c4ccccc4F)cc3[nH]2)cc1.
What is the InChIKey of [4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone?
The InChIKey is XVGDFFXKGJWLTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H16FN3O/c26-21-9-5-4-8-20(21)19-14-22-25(27-15-19)29-24(28-22)18-12-10-17(11-13-18)23(30)16-6-2-1-3-7-16/h1-15H,(H,27,28,29).
What are the key properties of [4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone?
[4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone has a molecular weight of 393.42 g/mol, XLogP of 5.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]-phenylmethanone is sourced from PubChem (CID 23025894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).