3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione

C22H18N4O2 — CID 69373508

IUPAC3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione
SMILESCC(C)n1cc(C2=C(c3cnc4ccccn34)C(=O)NC2=O)c2ccccc21
InChIInChI=1S/C22H18N4O2/c1-13(2)26-12-15(14-7-3-4-8-16(14)26)19-20(22(28)24-21(19)27)17-11-23-18-9-5-6-10-25(17)18/h3-13H,1-2H3,(H,24,27,28)
InChIKeyWBDBZULPYMAVTJ-UHFFFAOYSA-N
MW370.41 g/mol
LogP3.44
Rot. Bonds3

About 3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione

3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione (PubChem CID 69373508) has the molecular formula C22H18N4O2 and a molecular weight of 370.41 g/mol. Its IUPAC name is 3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione.

Molecular Properties

Compound Name3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione
PubChem CID69373508
Molecular FormulaC22H18N4O2
Molecular Weight370.41 g/mol
Exact Mass370.14
IUPAC Name3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione
SMILESCC(C)n1cc(C2=C(c3cnc4ccccn34)C(=O)NC2=O)c2ccccc21
InChIInChI=1S/C22H18N4O2/c1-13(2)26-12-15(14-7-3-4-8-16(14)26)19-20(22(28)24-21(19)27)17-11-23-18-9-5-6-10-25(17)18/h3-13H,1-2H3,(H,24,27,28)
InChIKeyWBDBZULPYMAVTJ-UHFFFAOYSA-N
XLogP3.44
TPSA68.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione?
The IUPAC name of 3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione (CID 69373508) is 3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione.
What is the SMILES notation for 3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione?
The canonical SMILES for 3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione is CC(C)n1cc(C2=C(c3cnc4ccccn34)C(=O)NC2=O)c2ccccc21.
What is the InChIKey of 3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione?
The InChIKey is WBDBZULPYMAVTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O2/c1-13(2)26-12-15(14-7-3-4-8-16(14)26)19-20(22(28)24-21(19)27)17-11-23-18-9-5-6-10-25(17)18/h3-13H,1-2H3,(H,24,27,28).
What are the key properties of 3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione?
3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione has a molecular weight of 370.41 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazo[1,2-a]pyridin-3-yl-4-(1-propan-2-ylindol-3-yl)pyrrole-2,5-dione is sourced from PubChem (CID 69373508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).