N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid

C75H75N5O12 — CID 158145234

About N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid

N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid (PubChem CID 158145234) has the molecular formula C75H75N5O12 and a molecular weight of 1238.45 g/mol. Its IUPAC name is N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid.

Molecular Properties

• Compound Name: N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid
• PubChem CID: 158145234
• Molecular Formula: C75H75N5O12
• Molecular Weight: 1238.45 g/mol
• Exact Mass: 1237.54
• IUPAC Name: N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid
• SMILES: COC(=O)c1cccc2c1CC1(CCN(c3ccc(C)cc3)C1=O)C2.COC(=O)c1cccc2c1CC1(CCNC1=O)C2.Cc1ccc(N2CCC3(Cc4cccc(C(=O)NO)c4C3)C2=O)cc1.Cc1ccc(N2CCC3(Cc4cccc(C(=O)O)c4C3)C2=O)cc1
• InChI: InChI=1S/C21H21NO3.C20H20N2O3.C20H19NO3.C14H15NO3/c1-14-6-8-16(9-7-14)22-11-10-21(20(22)24)12-15-4-3-5-17(18(15)13-21)19(23)25-2;1-13-5-7-15(8-6-13)22-10-9-20(19(22)24)11-14-3-2-4-16(17(14)12-20)18(23)21-25;1-13-5-7-15(8-6-13)21-10-9-20(19(21)24)11-14-3-2-4-16(18(22)23)17(14)12-20;1-18-12(16)10-4-2-3-9-7-14(8-11(9)10)5-6-15-13(14)17/h3-9H,10-13H2,1-2H3;2-8,25H,9-12H2,1H3,(H,21,23);2-8H,9-12H2,1H3,(H,22,23);2-4H,5-8H2,1H3,(H,15,17)
• InChIKey: FULAJDMPDVWFTD-UHFFFAOYSA-N
• XLogP: 10.23
• TPSA: 229.26 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 11
• Rotatable Bonds: 7
• Heavy Atoms: 92
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1238.45
LogP ≤ 5	10.23
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid?

The IUPAC name of N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid (CID 158145234) is N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid.

What is the SMILES notation for N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid?

The canonical SMILES for N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid is COC(=O)c1cccc2c1CC1(CCN(c3ccc(C)cc3)C1=O)C2.COC(=O)c1cccc2c1CC1(CCNC1=O)C2.Cc1ccc(N2CCC3(Cc4cccc(C(=O)NO)c4C3)C2=O)cc1.Cc1ccc(N2CCC3(Cc4cccc(C(=O)O)c4C3)C2=O)cc1.

What is the InChIKey of N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid?

The InChIKey is FULAJDMPDVWFTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO3.C20H20N2O3.C20H19NO3.C14H15NO3/c1-14-6-8-16(9-7-14)22-11-10-21(20(22)24)12-15-4-3-5-17(18(15)13-21)19(23)25-2;1-13-5-7-15(8-6-13)22-10-9-20(19(22)24)11-14-3-2-4-16(17(14)12-20)18(23)21-25;1-13-5-7-15(8-6-13)21-10-9-20(19(21)24)11-14-3-2-4-16(18(22)23)17(14)12-20;1-18-12(16)10-4-2-3-9-7-14(8-11(9)10)5-6-15-13(14)17/h3-9H,10-13H2,1-2H3;2-8,25H,9-12H2,1H3,(H,21,23);2-8H,9-12H2,1H3,(H,22,23);2-4H,5-8H2,1H3,(H,15,17).

What are the key properties of N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid?

N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid has a molecular weight of 1238.45 g/mol, XLogP of 10.23, 7 rotatable bonds, 4 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for N-hydroxy-1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl 2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;1'-(4-methylphenyl)-2'-oxospiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylic acid is sourced from PubChem (CID 158145234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).