6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine

C23H23FN6O — CID 155817683

IUPAC6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine
SMILESCOc1cccc(F)c1-c1cc2c(cn1)cnn2-c1cccc(N2CCN(C)CC2)n1
InChIInChI=1S/C23H23FN6O/c1-28-9-11-29(12-10-28)21-7-4-8-22(27-21)30-19-13-18(25-14-16(19)15-26-30)23-17(24)5-3-6-20(23)31-2/h3-8,13-15H,9-12H2,1-2H3
InChIKeyKAOYHQWWTGUIBS-UHFFFAOYSA-N
MW418.48 g/mol
LogP3.38
Rot. Bonds4

About 6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine

6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine (PubChem CID 155817683) has the molecular formula C23H23FN6O and a molecular weight of 418.48 g/mol. Its IUPAC name is 6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine
PubChem CID155817683
Molecular FormulaC23H23FN6O
Molecular Weight418.48 g/mol
Exact Mass418.19
IUPAC Name6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine
SMILESCOc1cccc(F)c1-c1cc2c(cn1)cnn2-c1cccc(N2CCN(C)CC2)n1
InChIInChI=1S/C23H23FN6O/c1-28-9-11-29(12-10-28)21-7-4-8-22(27-21)30-19-13-18(25-14-16(19)15-26-30)23-17(24)5-3-6-20(23)31-2/h3-8,13-15H,9-12H2,1-2H3
InChIKeyKAOYHQWWTGUIBS-UHFFFAOYSA-N
XLogP3.38
TPSA59.31 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.48
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine with MolForge

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Related Compounds

Pyrazolopyridazine 1
CID 6539361
Pyrazolo[1,5-b]pyridazine deriv. 43
CID 6539385
Pyrazolo[1,5-b]pyridazine deriv. 69
CID 6539411
Pyrazolo[1,5-b]pyridazine deriv. 70
CID 6539412
N,N-Dimethyl-3-(4-(3-(4-quinolinyl)pyrazolo(1,5-a)pyrimidin-6-yl)phenoxy)-1-propanamine
CID 50997749
N-(2,4-difluorophenyl)-3-(2-methoxy-5-(3-(4-methylpiperazin-1-yl)prop-1-ynyl)phenyl)-1H-pyrazolo[3,4-d]pyrimidin-6-amine
CID 11634558
4-[6-(4-Methoxyphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]quinoline
CID 44223357
7-(4-((1S,4S)-2,5-diazabicyclo[2.2.1]heptan-2-yl)-2-fluorophenyl)-3-(3-methoxyphenyl)-2-(pyridin-4-yl)pyrazolo[1,5-a]pyrimidine
CID 46879452
3-(4-fluoro-3-methoxyphenyl)-7-(2-methyl-4-((1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl)phenyl)-2-(pyridin-4-yl)pyrazolo[1,5-a]pyrimidine
CID 46879520
7-(2-Methoxyphenyl)-N-(4-(4-methylpiperazin-1-yl)phenyl)pyrrolo[2,1-f][1,2,4]triazin-2-amine
CID 54577892
7-(6-methoxy-3-pyridinyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]pyrrolo[2,1-f][1,2,4]triazin-2-amine
CID 57390672
[7-(2-Methoxy-phenyl)-pyrrolo[2,1-f][1,2,4]triazin-2-yl]-[3-(4-methyl-piperazin-1-yl)-phenyl]-amine
CID 57402937

Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine?
The IUPAC name of 6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine (CID 155817683) is 6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine?
The canonical SMILES for 6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine is COc1cccc(F)c1-c1cc2c(cn1)cnn2-c1cccc(N2CCN(C)CC2)n1.
What is the InChIKey of 6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine?
The InChIKey is KAOYHQWWTGUIBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23FN6O/c1-28-9-11-29(12-10-28)21-7-4-8-22(27-21)30-19-13-18(25-14-16(19)15-26-30)23-17(24)5-3-6-20(23)31-2/h3-8,13-15H,9-12H2,1-2H3.
What are the key properties of 6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine?
6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine has a molecular weight of 418.48 g/mol, XLogP of 3.38, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 155817683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).