1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione

C25H28N4O2 — CID 10024937

IUPAC1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione
SMILESO=C1CCC(=O)N1CCCN1CCC(c2nc(-c3ccccc3)c3ccccn23)CC1
InChIInChI=1S/C25H28N4O2/c30-22-10-11-23(31)29(22)16-6-14-27-17-12-20(13-18-27)25-26-24(19-7-2-1-3-8-19)21-9-4-5-15-28(21)25/h1-5,7-9,15,20H,6,10-14,16-18H2
InChIKeyMSYXZVMEYFFLAL-UHFFFAOYSA-N
MW416.53 g/mol
LogP3.72
Rot. Bonds6

About 1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione

1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione (PubChem CID 10024937) has the molecular formula C25H28N4O2 and a molecular weight of 416.53 g/mol. Its IUPAC name is 1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione
PubChem CID10024937
Molecular FormulaC25H28N4O2
Molecular Weight416.53 g/mol
Exact Mass416.22
IUPAC Name1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione
SMILESO=C1CCC(=O)N1CCCN1CCC(c2nc(-c3ccccc3)c3ccccn23)CC1
InChIInChI=1S/C25H28N4O2/c30-22-10-11-23(31)29(22)16-6-14-27-17-12-20(13-18-27)25-26-24(19-7-2-1-3-8-19)21-9-4-5-15-28(21)25/h1-5,7-9,15,20H,6,10-14,16-18H2
InChIKeyMSYXZVMEYFFLAL-UHFFFAOYSA-N
XLogP3.72
TPSA57.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.53
LogP ≤ 53.72
H-Bond Donors ≤ 50
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 1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione?
The IUPAC name of 1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione (CID 10024937) is 1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione.
What is the SMILES notation for 1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione?
The canonical SMILES for 1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione is O=C1CCC(=O)N1CCCN1CCC(c2nc(-c3ccccc3)c3ccccn23)CC1.
What is the InChIKey of 1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione?
The InChIKey is MSYXZVMEYFFLAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N4O2/c30-22-10-11-23(31)29(22)16-6-14-27-17-12-20(13-18-27)25-26-24(19-7-2-1-3-8-19)21-9-4-5-15-28(21)25/h1-5,7-9,15,20H,6,10-14,16-18H2.
What are the key properties of 1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione?
1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione has a molecular weight of 416.53 g/mol, XLogP of 3.72, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[4-(1-phenylimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propyl]pyrrolidine-2,5-dione is sourced from PubChem (CID 10024937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).