1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine

C16H19N5 — CID 2459333

IUPAC1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine
SMILESCc1cc(C)nc(-n2nc(C)c3c(C)c(C)c(C)nc32)n1
InChIInChI=1S/C16H19N5/c1-8-7-9(2)18-16(17-8)21-15-14(13(6)20-21)11(4)10(3)12(5)19-15/h7H,1-6H3
InChIKeyWVJUVTHUJZABDA-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.06
Rot. Bonds1

About 1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine

1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine (PubChem CID 2459333) has the molecular formula C16H19N5 and a molecular weight of 281.36 g/mol. Its IUPAC name is 1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine.

Molecular Properties

Compound Name1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine
PubChem CID2459333
Molecular FormulaC16H19N5
Molecular Weight281.36 g/mol
Exact Mass281.16
IUPAC Name1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine
SMILESCc1cc(C)nc(-n2nc(C)c3c(C)c(C)c(C)nc32)n1
InChIInChI=1S/C16H19N5/c1-8-7-9(2)18-16(17-8)21-15-14(13(6)20-21)11(4)10(3)12(5)19-15/h7H,1-6H3
InChIKeyWVJUVTHUJZABDA-UHFFFAOYSA-N
XLogP3.06
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine?
The IUPAC name of 1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine (CID 2459333) is 1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine.
What is the SMILES notation for 1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine?
The canonical SMILES for 1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine is Cc1cc(C)nc(-n2nc(C)c3c(C)c(C)c(C)nc32)n1.
What is the InChIKey of 1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine?
The InChIKey is WVJUVTHUJZABDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5/c1-8-7-9(2)18-16(17-8)21-15-14(13(6)20-21)11(4)10(3)12(5)19-15/h7H,1-6H3.
What are the key properties of 1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine?
1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine has a molecular weight of 281.36 g/mol, XLogP of 3.06, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethylpyrimidin-2-yl)-3,4,5,6-tetramethylpyrazolo[5,4-b]pyridine is sourced from PubChem (CID 2459333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).