4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine

C16H9FN8 — CID 136944028

IUPAC4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine
SMILESFc1c(-c2cncnc2)ncc2[nH]nc(-c3nc4ccncc4[nH]3)c12
InChIInChI=1S/C16H9FN8/c17-13-12-11(6-21-14(13)8-3-19-7-20-4-8)24-25-15(12)16-22-9-1-2-18-5-10(9)23-16/h1-7H,(H,22,23)(H,24,25)
InChIKeyQJTKLUOYSHQJJX-UHFFFAOYSA-N
MW332.30 g/mol
LogP2.49
Rot. Bonds2

About 4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine

4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine (PubChem CID 136944028) has the molecular formula C16H9FN8 and a molecular weight of 332.30 g/mol. Its IUPAC name is 4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine
PubChem CID136944028
Molecular FormulaC16H9FN8
Molecular Weight332.30 g/mol
Exact Mass332.09
IUPAC Name4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine
SMILESFc1c(-c2cncnc2)ncc2[nH]nc(-c3nc4ccncc4[nH]3)c12
InChIInChI=1S/C16H9FN8/c17-13-12-11(6-21-14(13)8-3-19-7-20-4-8)24-25-15(12)16-22-9-1-2-18-5-10(9)23-16/h1-7H,(H,22,23)(H,24,25)
InChIKeyQJTKLUOYSHQJJX-UHFFFAOYSA-N
XLogP2.49
TPSA108.92 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.30
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-fluoro-3-(1H-imidazo[4,5-b]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine
CID 137102119
N-[[5-[4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]methyl]ethanamine
CID 136944010
4-fluoro-3-(4-pyridin-2-yl-1H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine
CID 136943925
4-fluoro-3-[4-(5-fluorothiophen-2-yl)-1H-benzimidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine
CID 136942818
4-fluoro-3-[4-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine
CID 136942688
2-(1H-indazol-3-yl)-3H-imidazo[4,5-c]pyridine
CID 135820355
3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyridin-3-yl-1H-pyrazolo[4,3-b]pyridine
CID 137038916
2-(6-fluoro-1H-indazol-3-yl)-3H-imidazo[4,5-c]pyridine
CID 135820256
1-[5-[2-(4-fluoro-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-3H-imidazo[4,5-c]pyridin-7-yl]thiophen-2-yl]ethanone
CID 136947091
N-[5-[3-(1H-benzimidazol-2-yl)-4-fluoro-1H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]cyclopropanecarboxamide
CID 136942705
4-fluoro-3-[4-(2-fluorophenyl)-1H-benzimidazol-2-yl]-5-(4-methyl-3-pyridinyl)-1H-pyrazolo[3,4-c]pyridine
CID 136942518
N-[[5-[4-fluoro-3-(7-pyridin-3-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]methyl]ethanamine
CID 136946804

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine?
The IUPAC name of 4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine (CID 136944028) is 4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine.
What is the SMILES notation for 4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine?
The canonical SMILES for 4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine is Fc1c(-c2cncnc2)ncc2[nH]nc(-c3nc4ccncc4[nH]3)c12.
What is the InChIKey of 4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine?
The InChIKey is QJTKLUOYSHQJJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9FN8/c17-13-12-11(6-21-14(13)8-3-19-7-20-4-8)24-25-15(12)16-22-9-1-2-18-5-10(9)23-16/h1-7H,(H,22,23)(H,24,25).
What are the key properties of 4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine?
4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine has a molecular weight of 332.30 g/mol, XLogP of 2.49, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 136944028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).