1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate

C47H58N4O6 — CID 157443308

About 1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate

1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate (PubChem CID 157443308) has the molecular formula C47H58N4O6 and a molecular weight of 775.00 g/mol. Its IUPAC name is 1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate.

Molecular Properties

• Compound Name: 1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate
• PubChem CID: 157443308
• Molecular Formula: C47H58N4O6
• Molecular Weight: 775.00 g/mol
• Exact Mass: 774.44
• IUPAC Name: 1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate
• SMILES: COC(=O)c1cccc2c1CC1(CCN(C3CC3)C1)C2.COC(=O)c1cccc2c1CC1(CCNC1)C2.O=C(NO)c1cccc2c1CC1(CCN(C3CC3)C1)C2
• InChI: InChI=1S/C17H21NO2.C16H20N2O2.C14H17NO2/c1-20-16(19)14-4-2-3-12-9-17(10-15(12)14)7-8-18(11-17)13-5-6-13;19-15(17-20)13-3-1-2-11-8-16(9-14(11)13)6-7-18(10-16)12-4-5-12;1-17-13(16)11-4-2-3-10-7-14(8-12(10)11)5-6-15-9-14/h2-4,13H,5-11H2,1H3;1-3,12,20H,4-10H2,(H,17,19);2-4,15H,5-9H2,1H3
• InChIKey: BRXWDQYAOVLDCZ-UHFFFAOYSA-N
• XLogP: 5.74
• TPSA: 120.44 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 9
• Rotatable Bonds: 5
• Heavy Atoms: 57
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	775.00
LogP ≤ 5	5.74
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	9

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 1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate?

The IUPAC name of 1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate (CID 157443308) is 1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate.

What is the SMILES notation for 1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate?

The canonical SMILES for 1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate is COC(=O)c1cccc2c1CC1(CCN(C3CC3)C1)C2.COC(=O)c1cccc2c1CC1(CCNC1)C2.O=C(NO)c1cccc2c1CC1(CCN(C3CC3)C1)C2.

What is the InChIKey of 1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate?

The InChIKey is BRXWDQYAOVLDCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2.C16H20N2O2.C14H17NO2/c1-20-16(19)14-4-2-3-12-9-17(10-15(12)14)7-8-18(11-17)13-5-6-13;19-15(17-20)13-3-1-2-11-8-16(9-14(11)13)6-7-18(10-16)12-4-5-12;1-17-13(16)11-4-2-3-10-7-14(8-12(10)11)5-6-15-9-14/h2-4,13H,5-11H2,1H3;1-3,12,20H,4-10H2,(H,17,19);2-4,15H,5-9H2,1H3.

What are the key properties of 1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate?

1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate has a molecular weight of 775.00 g/mol, XLogP of 5.74, 5 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 1'-cyclopropyl-N-hydroxyspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxamide;methyl 1'-cyclopropylspiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate;methyl spiro[1,3-dihydroindene-2,3'-pyrrolidine]-4-carboxylate is sourced from PubChem (CID 157443308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).