3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one

C17H11FN4O — CID 71267884

IUPAC3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one
SMILESO=c1cc[nH]cc1-c1cc2c(-c3ccccc3F)n[nH]c2cn1
InChIInChI=1S/C17H11FN4O/c18-13-4-2-1-3-10(13)17-11-7-14(20-9-15(11)21-22-17)12-8-19-6-5-16(12)23/h1-9H,(H,19,23)(H,21,22)
InChIKeyYRLLJNVYXRIVKG-UHFFFAOYSA-N
MW306.30 g/mol
LogP3.12
Rot. Bonds2

About 3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one

3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one (PubChem CID 71267884) has the molecular formula C17H11FN4O and a molecular weight of 306.30 g/mol. Its IUPAC name is 3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one.

Molecular Properties

Compound Name3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one
PubChem CID71267884
Molecular FormulaC17H11FN4O
Molecular Weight306.30 g/mol
Exact Mass306.09
IUPAC Name3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one
SMILESO=c1cc[nH]cc1-c1cc2c(-c3ccccc3F)n[nH]c2cn1
InChIInChI=1S/C17H11FN4O/c18-13-4-2-1-3-10(13)17-11-7-14(20-9-15(11)21-22-17)12-8-19-6-5-16(12)23/h1-9H,(H,19,23)(H,21,22)
InChIKeyYRLLJNVYXRIVKG-UHFFFAOYSA-N
XLogP3.12
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.30
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-fluorophenyl)-5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine
CID 71254121
5-[4-(azetidin-3-yloxy)-3-pyridinyl]-3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridine
CID 71253658
3-(2-fluorophenyl)-5-(6-piperidin-1-ylpyrazin-2-yl)-1H-pyrazolo[3,4-c]pyridine
CID 123624440
3-[4-(2-fluorophenyl)-1H-pyrrolo[2,3-c]pyridin-2-yl]-5-(1H-pyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine
CID 137116416
3-[4-(2-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine
CID 137111299
3-[4-(2-fluorophenyl)-1H-imidazo[4,5-c]pyridin-2-yl]-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine
CID 136944247
1-[6-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]pyrazin-2-yl]pyrrolidin-3-amine
CID 71253272
5-(2,3-dimethylimidazol-4-yl)-3-[4-(2-fluorophenyl)-1H-pyrrolo[2,3-c]pyridin-2-yl]-1H-pyrazolo[3,4-c]pyridine
CID 137311707
1-[5-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]azepan-4-amine
CID 71253819
acetylene;3-[5-amino-4-(2-fluorobenzenecarboximidoyl)-2-pyridinyl]-1H-pyridin-4-one;piperidine
CID 144529529
5-[3-[7-(2-fluorophenyl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]-N,N-dimethylpyridin-3-amine
CID 136946416
N-[[5-[3-[4-(2-fluorophenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]methyl]-1-phenylmethanamine
CID 137110605

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one?
The IUPAC name of 3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one (CID 71267884) is 3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one.
What is the SMILES notation for 3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one?
The canonical SMILES for 3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one is O=c1cc[nH]cc1-c1cc2c(-c3ccccc3F)n[nH]c2cn1.
What is the InChIKey of 3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one?
The InChIKey is YRLLJNVYXRIVKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11FN4O/c18-13-4-2-1-3-10(13)17-11-7-14(20-9-15(11)21-22-17)12-8-19-6-5-16(12)23/h1-9H,(H,19,23)(H,21,22).
What are the key properties of 3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one?
3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one has a molecular weight of 306.30 g/mol, XLogP of 3.12, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-fluorophenyl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-1H-pyridin-4-one is sourced from PubChem (CID 71267884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).