dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate

C90H110BrF5K2N12O33 — CID 165001385

About dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate

dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate (PubChem CID 165001385) has the molecular formula C90H110BrF5K2N12O33 and a molecular weight of 2141.01 g/mol. Its IUPAC name is dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate.

Molecular Properties

• Compound Name: dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate
• PubChem CID: 165001385
• Molecular Formula: C90H110BrF5K2N12O33
• Molecular Weight: 2141.01 g/mol
• Exact Mass: 2138.57
• IUPAC Name: dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate
• SMILES: C.C.C.C.CC(=O)Nc1cc2c(cc1F)C1(CC2)OC(=O)N(CC(=O)OC(C)(C)C)C1=O.CC(=O)Nc1cc2c(cc1F)C1(CC2)OC(=O)NC1=O.CC(C)(C)OC(=O)CBr.CNC(=O)Nc1cc2c(cc1F)[C@@]1(CC2)OC(=O)N(CC(=O)OC)C1=O.CNC(=O)Nc1cc2c(cc1F)[C@]1(CC2)OC(=O)N(CC(=O)OC)C1=O.CO.COC(=O)CN1C(=O)OC2(CCc3cc(N)c(F)cc32)C1=O.O=CO[O-].[H-].[K+].[K+]
• InChI: InChI=1S/C19H21FN2O6.2C16H16FN3O6.C14H13FN2O5.C13H11FN2O4.C6H11BrO2.CH2O3.CH4O.4CH4.2K.H/c1-10(23)21-14-7-11-5-6-19(12(11)8-13(14)20)16(25)22(17(26)28-19)9-15(24)27-18(2,3)4;2*1-18-14(23)19-11-5-8-3-4-16(9(8)6-10(11)17)13(22)20(15(24)26-16)7-12(21)25-2;1-21-11(18)6-17-12(19)14(22-13(17)20)3-2-7-4-10(16)9(15)5-8(7)14;1-6(17)15-10-4-7-2-3-13(8(7)5-9(10)14)11(18)16-12(19)20-13;1-6(2,3)9-5(8)4-7;2-1-4-3;1-2;;;;;;;/h7-8H,5-6,9H2,1-4H3,(H,21,23);2*5-6H,3-4,7H2,1-2H3,(H2,18,19,23);4-5H,2-3,6,16H2,1H3;4-5H,2-3H2,1H3,(H,15,17)(H,16,18,19);4H2,1-3H3;1,3H;2H,1H3;4*1H4;;;/q;;;;;;;;;;;;2*+1;-1/p-1/t;2*16-;;;;;;;;;;;;/m.10............/s1
• InChIKey: ZUETYFGRCNALDU-NHKBNEFBSA-M
• XLogP: 2.31
• TPSA: 609.41 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 34
• Rotatable Bonds: 14
• Heavy Atoms: 143
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2141.01
LogP ≤ 5	2.31
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate?

The IUPAC name of dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate (CID 165001385) is dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate.

What is the SMILES notation for dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate?

The canonical SMILES for dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate is C.C.C.C.CC(=O)Nc1cc2c(cc1F)C1(CC2)OC(=O)N(CC(=O)OC(C)(C)C)C1=O.CC(=O)Nc1cc2c(cc1F)C1(CC2)OC(=O)NC1=O.CC(C)(C)OC(=O)CBr.CNC(=O)Nc1cc2c(cc1F)[C@@]1(CC2)OC(=O)N(CC(=O)OC)C1=O.CNC(=O)Nc1cc2c(cc1F)[C@]1(CC2)OC(=O)N(CC(=O)OC)C1=O.CO.COC(=O)CN1C(=O)OC2(CCc3cc(N)c(F)cc32)C1=O.O=CO[O-].[H-].[K+].[K+].

What is the InChIKey of dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate?

The InChIKey is ZUETYFGRCNALDU-NHKBNEFBSA-M. The full InChI is InChI=1S/C19H21FN2O6.2C16H16FN3O6.C14H13FN2O5.C13H11FN2O4.C6H11BrO2.CH2O3.CH4O.4CH4.2K.H/c1-10(23)21-14-7-11-5-6-19(12(11)8-13(14)20)16(25)22(17(26)28-19)9-15(24)27-18(2,3)4;2*1-18-14(23)19-11-5-8-3-4-16(9(8)6-10(11)17)13(22)20(15(24)26-16)7-12(21)25-2;1-21-11(18)6-17-12(19)14(22-13(17)20)3-2-7-4-10(16)9(15)5-8(7)14;1-6(17)15-10-4-7-2-3-13(8(7)5-9(10)14)11(18)16-12(19)20-13;1-6(2,3)9-5(8)4-7;2-1-4-3;1-2;;;;;;;/h7-8H,5-6,9H2,1-4H3,(H,21,23);2*5-6H,3-4,7H2,1-2H3,(H2,18,19,23);4-5H,2-3,6,16H2,1H3;4-5H,2-3H2,1H3,(H,15,17)(H,16,18,19);4H2,1-3H3;1,3H;2H,1H3;4*1H4;;;/q;;;;;;;;;;;;2*+1;-1/p-1/t;2*16-;;;;;;;;;;;;/m.10............/s1.

What are the key properties of dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate?

dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate has a molecular weight of 2141.01 g/mol, XLogP of 2.31, 14 rotatable bonds, 9 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for dipotassium;tert-butyl 2-(6-acetamido-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;tert-butyl 2-bromoacetate;N-(6'-fluoro-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl)acetamide;hydride;methane;methanol;methyl 2-(6-amino-5-fluoro-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl)acetate;methyl 2-[(3S)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;methyl 2-[(3R)-5-fluoro-6-(methylcarbamoylamino)-2',4'-dioxospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-3'-yl]acetate;oxido formate is sourced from PubChem (CID 165001385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).