5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol

C24H16FN7O — CID 137057215

IUPAC5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol
SMILESCc1cc(F)cc(-c2ccnc3nc(-c4[nH]nc5ncc(-c6cncc(O)c6)cc45)[nH]c23)c1
InChIInChI=1S/C24H16FN7O/c1-12-4-13(6-16(25)5-12)18-2-3-27-23-20(18)29-24(30-23)21-19-8-15(10-28-22(19)32-31-21)14-7-17(33)11-26-9-14/h2-11,33H,1H3,(H,27,29,30)(H,28,31,32)
InChIKeyVJDAKPOOVHRWTG-UHFFFAOYSA-N
MW437.44 g/mol
LogP4.78
Rot. Bonds3

About 5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol

5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol (PubChem CID 137057215) has the molecular formula C24H16FN7O and a molecular weight of 437.44 g/mol. Its IUPAC name is 5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol.

Molecular Properties

Compound Name5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol
PubChem CID137057215
Molecular FormulaC24H16FN7O
Molecular Weight437.44 g/mol
Exact Mass437.14
IUPAC Name5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol
SMILESCc1cc(F)cc(-c2ccnc3nc(-c4[nH]nc5ncc(-c6cncc(O)c6)cc45)[nH]c23)c1
InChIInChI=1S/C24H16FN7O/c1-12-4-13(6-16(25)5-12)18-2-3-27-23-20(18)29-24(30-23)21-19-8-15(10-28-22(19)32-31-21)14-7-17(33)11-26-9-14/h2-11,33H,1H3,(H,27,29,30)(H,28,31,32)
InChIKeyVJDAKPOOVHRWTG-UHFFFAOYSA-N
XLogP4.78
TPSA116.26 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.44
LogP ≤ 54.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol?
The IUPAC name of 5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol (CID 137057215) is 5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol.
What is the SMILES notation for 5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol?
The canonical SMILES for 5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol is Cc1cc(F)cc(-c2ccnc3nc(-c4[nH]nc5ncc(-c6cncc(O)c6)cc45)[nH]c23)c1.
What is the InChIKey of 5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol?
The InChIKey is VJDAKPOOVHRWTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16FN7O/c1-12-4-13(6-16(25)5-12)18-2-3-27-23-20(18)29-24(30-23)21-19-8-15(10-28-22(19)32-31-21)14-7-17(33)11-26-9-14/h2-11,33H,1H3,(H,27,29,30)(H,28,31,32).
What are the key properties of 5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol?
5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol has a molecular weight of 437.44 g/mol, XLogP of 4.78, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol is sourced from PubChem (CID 137057215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).