(2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide

C25H37N3O7Si — CID 23928506

About (2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide

(2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide (PubChem CID 23928506) has the molecular formula C25H37N3O7Si and a molecular weight of 519.67 g/mol. Its IUPAC name is (2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide.

Molecular Properties

• Compound Name: (2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide
• PubChem CID: 23928506
• Molecular Formula: C25H37N3O7Si
• Molecular Weight: 519.67 g/mol
• Exact Mass: 519.24
• IUPAC Name: (2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide
• SMILES: C[C@H](O)C(=O)Nc1ccc2c(c1)[C@@]1(O[C@H](CC(=O)N3CCC[C@H]3CO)[C@@H]([Si](C)(C)O)[C@@H]1C)C(=O)N2C
• InChI: InChI=1S/C25H37N3O7Si/c1-14-22(36(4,5)34)20(12-21(31)28-10-6-7-17(28)13-29)35-25(14)18-11-16(26-23(32)15(2)30)8-9-19(18)27(3)24(25)33/h8-9,11,14-15,17,20,22,29-30,34H,6-7,10,12-13H2,1-5H3,(H,26,32)/t14-,15-,17-,20+,22-,25+/m0/s1
• InChIKey: VQNXSCFZGMCDQU-DBDDKXCASA-N
• XLogP: 1.15
• TPSA: 139.64 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	519.67
LogP ≤ 5	1.15
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide?

The IUPAC name of (2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide (CID 23928506) is (2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide.

What is the SMILES notation for (2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide?

The canonical SMILES for (2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide is C[C@H](O)C(=O)Nc1ccc2c(c1)[C@@]1(O[C@H](CC(=O)N3CCC[C@H]3CO)[C@@H]([Si](C)(C)O)[C@@H]1C)C(=O)N2C.

What is the InChIKey of (2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide?

The InChIKey is VQNXSCFZGMCDQU-DBDDKXCASA-N. The full InChI is InChI=1S/C25H37N3O7Si/c1-14-22(36(4,5)34)20(12-21(31)28-10-6-7-17(28)13-29)35-25(14)18-11-16(26-23(32)15(2)30)8-9-19(18)27(3)24(25)33/h8-9,11,14-15,17,20,22,29-30,34H,6-7,10,12-13H2,1-5H3,(H,26,32)/t14-,15-,17-,20+,22-,25+/m0/s1.

What are the key properties of (2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide?

(2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide has a molecular weight of 519.67 g/mol, XLogP of 1.15, 6 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for (2S)-2-hydroxy-N-[(3R,3'R,4'S,5'R)-4'-[hydroxy(dimethyl)silyl]-5'-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethyl]-1,3'-dimethyl-2-oxospiro[indole-3,2'-oxolane]-5-yl]propanamide is sourced from PubChem (CID 23928506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).