5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine

C19H16N8 — CID 71254308

IUPAC5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine
SMILESCn1cc(-c2cc3c(-c4cccc(-c5cnn(C)c5)n4)n[nH]c3cn2)cn1
InChIInChI=1S/C19H16N8/c1-26-10-12(7-21-26)15-4-3-5-16(23-15)19-14-6-17(13-8-22-27(2)11-13)20-9-18(14)24-25-19/h3-11H,1-2H3,(H,24,25)
InChIKeyBNSKVRMPHSXDLO-UHFFFAOYSA-N
MW356.39 g/mol
LogP2.82
Rot. Bonds3

About 5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine

5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine (PubChem CID 71254308) has the molecular formula C19H16N8 and a molecular weight of 356.39 g/mol. Its IUPAC name is 5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine
PubChem CID71254308
Molecular FormulaC19H16N8
Molecular Weight356.39 g/mol
Exact Mass356.15
IUPAC Name5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine
SMILESCn1cc(-c2cc3c(-c4cccc(-c5cnn(C)c5)n4)n[nH]c3cn2)cn1
InChIInChI=1S/C19H16N8/c1-26-10-12(7-21-26)15-4-3-5-16(23-15)19-14-6-17(13-8-22-27(2)11-13)20-9-18(14)24-25-19/h3-11H,1-2H3,(H,24,25)
InChIKeyBNSKVRMPHSXDLO-UHFFFAOYSA-N
XLogP2.82
TPSA90.10 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.39
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine?
The IUPAC name of 5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine (CID 71254308) is 5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine.
What is the SMILES notation for 5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine?
The canonical SMILES for 5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine is Cn1cc(-c2cc3c(-c4cccc(-c5cnn(C)c5)n4)n[nH]c3cn2)cn1.
What is the InChIKey of 5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine?
The InChIKey is BNSKVRMPHSXDLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N8/c1-26-10-12(7-21-26)15-4-3-5-16(23-15)19-14-6-17(13-8-22-27(2)11-13)20-9-18(14)24-25-19/h3-11H,1-2H3,(H,24,25).
What are the key properties of 5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine?
5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine has a molecular weight of 356.39 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylpyrazol-4-yl)-3-[6-(1-methylpyrazol-4-yl)-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 71254308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).