2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine

C18H18N6 — CID 171913921

IUPAC2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine
SMILESCc1ccc(-c2cc(-c3ccnn3C)nc3nn(C)c(C)c23)nc1
InChIInChI=1S/C18H18N6/c1-11-5-6-14(19-10-11)13-9-15(16-7-8-20-24(16)4)21-18-17(13)12(2)23(3)22-18/h5-10H,1-4H3
InChIKeyFMYNZBOASBJUNQ-UHFFFAOYSA-N
MW318.38 g/mol
LogP3.05
Rot. Bonds2

About 2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine

2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine (PubChem CID 171913921) has the molecular formula C18H18N6 and a molecular weight of 318.38 g/mol. Its IUPAC name is 2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine
PubChem CID171913921
Molecular FormulaC18H18N6
Molecular Weight318.38 g/mol
Exact Mass318.16
IUPAC Name2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine
SMILESCc1ccc(-c2cc(-c3ccnn3C)nc3nn(C)c(C)c23)nc1
InChIInChI=1S/C18H18N6/c1-11-5-6-14(19-10-11)13-9-15(16-7-8-20-24(16)4)21-18-17(13)12(2)23(3)22-18/h5-10H,1-4H3
InChIKeyFMYNZBOASBJUNQ-UHFFFAOYSA-N
XLogP3.05
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine?
The IUPAC name of 2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine (CID 171913921) is 2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine.
What is the SMILES notation for 2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine?
The canonical SMILES for 2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine is Cc1ccc(-c2cc(-c3ccnn3C)nc3nn(C)c(C)c23)nc1.
What is the InChIKey of 2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine?
The InChIKey is FMYNZBOASBJUNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N6/c1-11-5-6-14(19-10-11)13-9-15(16-7-8-20-24(16)4)21-18-17(13)12(2)23(3)22-18/h5-10H,1-4H3.
What are the key properties of 2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine?
2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine has a molecular weight of 318.38 g/mol, XLogP of 3.05, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-6-(2-methylpyrazol-3-yl)-4-(5-methyl-2-pyridinyl)pyrazolo[3,4-b]pyridine is sourced from PubChem (CID 171913921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).