5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one

C15H12N6O — CID 92567025

IUPAC5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCn1cc(-c2cc(=O)n3[nH]c(-c4ccccn4)cc3n2)cn1
InChIInChI=1S/C15H12N6O/c1-20-9-10(8-17-20)12-7-15(22)21-14(18-12)6-13(19-21)11-4-2-3-5-16-11/h2-9,19H,1H3
InChIKeyZHRQWQXUMDULQZ-UHFFFAOYSA-N
MW292.30 g/mol
LogP1.49
Rot. Bonds2

About 5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one

5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 92567025) has the molecular formula C15H12N6O and a molecular weight of 292.30 g/mol. Its IUPAC name is 5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID92567025
Molecular FormulaC15H12N6O
Molecular Weight292.30 g/mol
Exact Mass292.11
IUPAC Name5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCn1cc(-c2cc(=O)n3[nH]c(-c4ccccn4)cc3n2)cn1
InChIInChI=1S/C15H12N6O/c1-20-9-10(8-17-20)12-7-15(22)21-14(18-12)6-13(19-21)11-4-2-3-5-16-11/h2-9,19H,1H3
InChIKeyZHRQWQXUMDULQZ-UHFFFAOYSA-N
XLogP1.49
TPSA80.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.30
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 92567025) is 5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one is Cn1cc(-c2cc(=O)n3[nH]c(-c4ccccn4)cc3n2)cn1.
What is the InChIKey of 5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is ZHRQWQXUMDULQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N6O/c1-20-9-10(8-17-20)12-7-15(22)21-14(18-12)6-13(19-21)11-4-2-3-5-16-11/h2-9,19H,1H3.
What are the key properties of 5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 292.30 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylpyrazol-4-yl)-2-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 92567025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).