5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole

C21H16N4O — CID 24739643

IUPAC5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole
SMILESCc1onc(-c2ccccc2)c1-c1cn2cc(-n3cccc3)ccc2n1
InChIInChI=1S/C21H16N4O/c1-15-20(21(23-26-15)16-7-3-2-4-8-16)18-14-25-13-17(9-10-19(25)22-18)24-11-5-6-12-24/h2-14H,1H3
InChIKeyKWVGCNLXCJUADA-UHFFFAOYSA-N
MW340.39 g/mol
LogP4.76
Rot. Bonds3

About 5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole

5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole (PubChem CID 24739643) has the molecular formula C21H16N4O and a molecular weight of 340.39 g/mol. Its IUPAC name is 5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole.

Molecular Properties

Compound Name5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole
PubChem CID24739643
Molecular FormulaC21H16N4O
Molecular Weight340.39 g/mol
Exact Mass340.13
IUPAC Name5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole
SMILESCc1onc(-c2ccccc2)c1-c1cn2cc(-n3cccc3)ccc2n1
InChIInChI=1S/C21H16N4O/c1-15-20(21(23-26-15)16-7-3-2-4-8-16)18-14-25-13-17(9-10-19(25)22-18)24-11-5-6-12-24/h2-14H,1H3
InChIKeyKWVGCNLXCJUADA-UHFFFAOYSA-N
XLogP4.76
TPSA48.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.39
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole?
The IUPAC name of 5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole (CID 24739643) is 5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole.
What is the SMILES notation for 5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole?
The canonical SMILES for 5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole is Cc1onc(-c2ccccc2)c1-c1cn2cc(-n3cccc3)ccc2n1.
What is the InChIKey of 5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole?
The InChIKey is KWVGCNLXCJUADA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N4O/c1-15-20(21(23-26-15)16-7-3-2-4-8-16)18-14-25-13-17(9-10-19(25)22-18)24-11-5-6-12-24/h2-14H,1H3.
What are the key properties of 5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole?
5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole has a molecular weight of 340.39 g/mol, XLogP of 4.76, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-phenyl-4-(6-pyrrol-1-ylimidazo[1,2-a]pyridin-2-yl)-1,2-oxazole is sourced from PubChem (CID 24739643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).