5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one

C19H14N6O — CID 70925366

IUPAC5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCc1[nH]nc2ccc(-c3cc(=O)n4[nH]cc(-c5ccccn5)c4n3)cc12
InChIInChI=1S/C19H14N6O/c1-11-13-8-12(5-6-16(13)24-23-11)17-9-18(26)25-19(22-17)14(10-21-25)15-4-2-3-7-20-15/h2-10,21H,1H3,(H,23,24)
InChIKeyOQQFHHVRTGLMEK-UHFFFAOYSA-N
MW342.36 g/mol
LogP2.94
Rot. Bonds2

About 5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one

5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 70925366) has the molecular formula C19H14N6O and a molecular weight of 342.36 g/mol. Its IUPAC name is 5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID70925366
Molecular FormulaC19H14N6O
Molecular Weight342.36 g/mol
Exact Mass342.12
IUPAC Name5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCc1[nH]nc2ccc(-c3cc(=O)n4[nH]cc(-c5ccccn5)c4n3)cc12
InChIInChI=1S/C19H14N6O/c1-11-13-8-12(5-6-16(13)24-23-11)17-9-18(26)25-19(22-17)14(10-21-25)15-4-2-3-7-20-15/h2-10,21H,1H3,(H,23,24)
InChIKeyOQQFHHVRTGLMEK-UHFFFAOYSA-N
XLogP2.94
TPSA91.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.36
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 70925366) is 5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one is Cc1[nH]nc2ccc(-c3cc(=O)n4[nH]cc(-c5ccccn5)c4n3)cc12.
What is the InChIKey of 5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is OQQFHHVRTGLMEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N6O/c1-11-13-8-12(5-6-16(13)24-23-11)17-9-18(26)25-19(22-17)14(10-21-25)15-4-2-3-7-20-15/h2-10,21H,1H3,(H,23,24).
What are the key properties of 5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 342.36 g/mol, XLogP of 2.94, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methyl-2H-indazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 70925366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).