2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine

C22H13FN6O — CID 137134511

IUPAC2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine
SMILESFc1cc(-c2cccnc2)cc2c(-c3nc4nccc(-c5ccoc5)c4[nH]3)[nH]nc12
InChIInChI=1S/C22H13FN6O/c23-17-9-14(12-2-1-5-24-10-12)8-16-18(17)28-29-20(16)22-26-19-15(13-4-7-30-11-13)3-6-25-21(19)27-22/h1-11H,(H,28,29)(H,25,26,27)
InChIKeyHCHOYJOFRCLYCW-UHFFFAOYSA-N
MW396.39 g/mol
LogP4.96
Rot. Bonds3

About 2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine

2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine (PubChem CID 137134511) has the molecular formula C22H13FN6O and a molecular weight of 396.39 g/mol. Its IUPAC name is 2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine
PubChem CID137134511
Molecular FormulaC22H13FN6O
Molecular Weight396.39 g/mol
Exact Mass396.11
IUPAC Name2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine
SMILESFc1cc(-c2cccnc2)cc2c(-c3nc4nccc(-c5ccoc5)c4[nH]3)[nH]nc12
InChIInChI=1S/C22H13FN6O/c23-17-9-14(12-2-1-5-24-10-12)8-16-18(17)28-29-20(16)22-26-19-15(13-4-7-30-11-13)3-6-25-21(19)27-22/h1-11H,(H,28,29)(H,25,26,27)
InChIKeyHCHOYJOFRCLYCW-UHFFFAOYSA-N
XLogP4.96
TPSA96.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.39
LogP ≤ 54.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine (CID 137134511) is 2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine is Fc1cc(-c2cccnc2)cc2c(-c3nc4nccc(-c5ccoc5)c4[nH]3)[nH]nc12.
What is the InChIKey of 2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is HCHOYJOFRCLYCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H13FN6O/c23-17-9-14(12-2-1-5-24-10-12)8-16-18(17)28-29-20(16)22-26-19-15(13-4-7-30-11-13)3-6-25-21(19)27-22/h1-11H,(H,28,29)(H,25,26,27).
What are the key properties of 2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine?
2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 396.39 g/mol, XLogP of 4.96, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-(furan-3-yl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 137134511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).