2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide

C26H27FN2O5 — CID 163540429

About 2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide

2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide (PubChem CID 163540429) has the molecular formula C26H27FN2O5 and a molecular weight of 466.51 g/mol. Its IUPAC name is 2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide.

Molecular Properties

• Compound Name: 2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide
• PubChem CID: 163540429
• Molecular Formula: C26H27FN2O5
• Molecular Weight: 466.51 g/mol
• Exact Mass: 466.19
• IUPAC Name: 2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide
• SMILES: CC(=O)Cc1ccc2c(c1)CC[C@@]21OC(=O)N(CC(=O)N(Cc2ccc(F)cc2)C(C)C)C1=O
• InChI: InChI=1S/C26H27FN2O5/c1-16(2)28(14-18-4-7-21(27)8-5-18)23(31)15-29-24(32)26(34-25(29)33)11-10-20-13-19(12-17(3)30)6-9-22(20)26/h4-9,13,16H,10-12,14-15H2,1-3H3/t26-/m1/s1
• InChIKey: UZKIJIOTZLZZFN-AREMUKBSSA-N
• XLogP: 3.51
• TPSA: 83.99 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	466.51
LogP ≤ 5	3.51
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide?

The IUPAC name of 2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide (CID 163540429) is 2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide.

What is the SMILES notation for 2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide?

The canonical SMILES for 2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide is CC(=O)Cc1ccc2c(c1)CC[C@@]21OC(=O)N(CC(=O)N(Cc2ccc(F)cc2)C(C)C)C1=O.

What is the InChIKey of 2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide?

The InChIKey is UZKIJIOTZLZZFN-AREMUKBSSA-N. The full InChI is InChI=1S/C26H27FN2O5/c1-16(2)28(14-18-4-7-21(27)8-5-18)23(31)15-29-24(32)26(34-25(29)33)11-10-20-13-19(12-17(3)30)6-9-22(20)26/h4-9,13,16H,10-12,14-15H2,1-3H3/t26-/m1/s1.

What are the key properties of 2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide?

2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide has a molecular weight of 466.51 g/mol, XLogP of 3.51, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(3R)-2',4'-dioxo-6-(2-oxopropyl)spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]-N-[(4-fluorophenyl)methyl]-N-propan-2-ylacetamide is sourced from PubChem (CID 163540429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).