2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide

C26H22N4O4 — CID 11712166

IUPAC2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide
SMILESO=C(CN1C[C@H](c2ccccc2)OC1=O)Nc1ccc2c(c1)CC1(C2)C(=O)Nc2ncccc21
InChIInChI=1S/C26H22N4O4/c31-22(15-30-14-21(34-25(30)33)16-5-2-1-3-6-16)28-19-9-8-17-12-26(13-18(17)11-19)20-7-4-10-27-23(20)29-24(26)32/h1-11,21H,12-15H2,(H,28,31)(H,27,29,32)/t21-,26?/m1/s1
InChIKeyIIPHBRKVOGIPKL-OSMGYRLQSA-N
MW454.49 g/mol
LogP3.20
Rot. Bonds4

About 2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide

2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide (PubChem CID 11712166) has the molecular formula C26H22N4O4 and a molecular weight of 454.49 g/mol. Its IUPAC name is 2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide.

Molecular Properties

Compound Name2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide
PubChem CID11712166
Molecular FormulaC26H22N4O4
Molecular Weight454.49 g/mol
Exact Mass454.16
IUPAC Name2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide
SMILESO=C(CN1C[C@H](c2ccccc2)OC1=O)Nc1ccc2c(c1)CC1(C2)C(=O)Nc2ncccc21
InChIInChI=1S/C26H22N4O4/c31-22(15-30-14-21(34-25(30)33)16-5-2-1-3-6-16)28-19-9-8-17-12-26(13-18(17)11-19)20-7-4-10-27-23(20)29-24(26)32/h1-11,21H,12-15H2,(H,28,31)(H,27,29,32)/t21-,26?/m1/s1
InChIKeyIIPHBRKVOGIPKL-OSMGYRLQSA-N
XLogP3.20
TPSA100.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.49
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide?
The IUPAC name of 2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide (CID 11712166) is 2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide.
What is the SMILES notation for 2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide?
The canonical SMILES for 2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide is O=C(CN1C[C@H](c2ccccc2)OC1=O)Nc1ccc2c(c1)CC1(C2)C(=O)Nc2ncccc21.
What is the InChIKey of 2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide?
The InChIKey is IIPHBRKVOGIPKL-OSMGYRLQSA-N. The full InChI is InChI=1S/C26H22N4O4/c31-22(15-30-14-21(34-25(30)33)16-5-2-1-3-6-16)28-19-9-8-17-12-26(13-18(17)11-19)20-7-4-10-27-23(20)29-24(26)32/h1-11,21H,12-15H2,(H,28,31)(H,27,29,32)/t21-,26?/m1/s1.
What are the key properties of 2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide?
2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide has a molecular weight of 454.49 g/mol, XLogP of 3.20, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5S)-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide is sourced from PubChem (CID 11712166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).