5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

C15H14N6O — CID 134439395

IUPAC5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
SMILESCC(C)c1c(-c2ccc3nccn3c2)nc2nc[nH]n2c1=O
InChIInChI=1S/C15H14N6O/c1-9(2)12-13(19-15-17-8-18-21(15)14(12)22)10-3-4-11-16-5-6-20(11)7-10/h3-9H,1-2H3,(H,17,18,19)
InChIKeyKQNIKBPSQABRCA-UHFFFAOYSA-N
MW294.32 g/mol
LogP1.86
Rot. Bonds2

About 5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one (PubChem CID 134439395) has the molecular formula C15H14N6O and a molecular weight of 294.32 g/mol. Its IUPAC name is 5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
PubChem CID134439395
Molecular FormulaC15H14N6O
Molecular Weight294.32 g/mol
Exact Mass294.12
IUPAC Name5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
SMILESCC(C)c1c(-c2ccc3nccn3c2)nc2nc[nH]n2c1=O
InChIInChI=1S/C15H14N6O/c1-9(2)12-13(19-15-17-8-18-21(15)14(12)22)10-3-4-11-16-5-6-20(11)7-10/h3-9H,1-2H3,(H,17,18,19)
InChIKeyKQNIKBPSQABRCA-UHFFFAOYSA-N
XLogP1.86
TPSA80.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.32
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one (CID 134439395) is 5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one is CC(C)c1c(-c2ccc3nccn3c2)nc2nc[nH]n2c1=O.
What is the InChIKey of 5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one?
The InChIKey is KQNIKBPSQABRCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N6O/c1-9(2)12-13(19-15-17-8-18-21(15)14(12)22)10-3-4-11-16-5-6-20(11)7-10/h3-9H,1-2H3,(H,17,18,19).
What are the key properties of 5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one?
5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one has a molecular weight of 294.32 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-imidazo[1,2-a]pyridin-6-yl-6-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 134439395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).