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

C17H11N7O — CID 74221706

IUPAC5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
SMILESO=c1cc(-c2ccc3[nH]ncc3c2)nc2nc(-c3ccccn3)[nH]n12
InChIInChI=1S/C17H11N7O/c25-15-8-14(10-4-5-12-11(7-10)9-19-22-12)20-17-21-16(23-24(15)17)13-3-1-2-6-18-13/h1-9H,(H,19,22)(H,20,21,23)
InChIKeyKRHXODCCUZVENL-UHFFFAOYSA-N
MW329.32 g/mol
LogP2.02
Rot. Bonds2

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

5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one (PubChem CID 74221706) has the molecular formula C17H11N7O and a molecular weight of 329.32 g/mol. Its IUPAC name is 5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
PubChem CID74221706
Molecular FormulaC17H11N7O
Molecular Weight329.32 g/mol
Exact Mass329.10
IUPAC Name5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
SMILESO=c1cc(-c2ccc3[nH]ncc3c2)nc2nc(-c3ccccn3)[nH]n12
InChIInChI=1S/C17H11N7O/c25-15-8-14(10-4-5-12-11(7-10)9-19-22-12)20-17-21-16(23-24(15)17)13-3-1-2-6-18-13/h1-9H,(H,19,22)(H,20,21,23)
InChIKeyKRHXODCCUZVENL-UHFFFAOYSA-N
XLogP2.02
TPSA104.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.32
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one (CID 74221706) is 5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one is O=c1cc(-c2ccc3[nH]ncc3c2)nc2nc(-c3ccccn3)[nH]n12.
What is the InChIKey of 5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one?
The InChIKey is KRHXODCCUZVENL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N7O/c25-15-8-14(10-4-5-12-11(7-10)9-19-22-12)20-17-21-16(23-24(15)17)13-3-1-2-6-18-13/h1-9H,(H,19,22)(H,20,21,23).
What are the key properties of 5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one?
5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one has a molecular weight of 329.32 g/mol, XLogP of 2.02, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-indazol-5-yl)-2-pyridin-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 74221706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).