3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide

C19H16N4O3 — CID 71984467

IUPAC3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide
SMILESO=C(NC1CC(=O)N(c2ccccc2)C1)c1cccc(-c2ncon2)c1
InChIInChI=1S/C19H16N4O3/c24-17-10-15(11-23(17)16-7-2-1-3-8-16)21-19(25)14-6-4-5-13(9-14)18-20-12-26-22-18/h1-9,12,15H,10-11H2,(H,21,25)
InChIKeyXVTKBDATVWJZHY-UHFFFAOYSA-N
MW348.36 g/mol
LogP2.27
Rot. Bonds4

About 3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide

3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide (PubChem CID 71984467) has the molecular formula C19H16N4O3 and a molecular weight of 348.36 g/mol. Its IUPAC name is 3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide.

Molecular Properties

Compound Name3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide
PubChem CID71984467
Molecular FormulaC19H16N4O3
Molecular Weight348.36 g/mol
Exact Mass348.12
IUPAC Name3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide
SMILESO=C(NC1CC(=O)N(c2ccccc2)C1)c1cccc(-c2ncon2)c1
InChIInChI=1S/C19H16N4O3/c24-17-10-15(11-23(17)16-7-2-1-3-8-16)21-19(25)14-6-4-5-13(9-14)18-20-12-26-22-18/h1-9,12,15H,10-11H2,(H,21,25)
InChIKeyXVTKBDATVWJZHY-UHFFFAOYSA-N
XLogP2.27
TPSA88.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.36
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide?
The IUPAC name of 3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide (CID 71984467) is 3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide.
What is the SMILES notation for 3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide?
The canonical SMILES for 3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide is O=C(NC1CC(=O)N(c2ccccc2)C1)c1cccc(-c2ncon2)c1.
What is the InChIKey of 3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide?
The InChIKey is XVTKBDATVWJZHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O3/c24-17-10-15(11-23(17)16-7-2-1-3-8-16)21-19(25)14-6-4-5-13(9-14)18-20-12-26-22-18/h1-9,12,15H,10-11H2,(H,21,25).
What are the key properties of 3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide?
3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide has a molecular weight of 348.36 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,2,4-oxadiazol-3-yl)-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide is sourced from PubChem (CID 71984467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).