N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide

C26H29FN6O6 — CID 167514466

About N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide

N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide (PubChem CID 167514466) has the molecular formula C26H29FN6O6 and a molecular weight of 540.55 g/mol. Its IUPAC name is N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide.

Molecular Properties

• Compound Name: N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide
• PubChem CID: 167514466
• Molecular Formula: C26H29FN6O6
• Molecular Weight: 540.55 g/mol
• Exact Mass: 540.21
• IUPAC Name: N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide
• SMILES: O=C1COc2ncc(N3CC(CCNCC4Cc5cc(NC(=O)C6CCOC6)cc(F)c5C4)OC3=O)nc2N1
• InChI: InChI=1S/C26H29FN6O6/c27-20-8-17(30-24(35)15-2-4-37-12-15)7-16-5-14(6-19(16)20)9-28-3-1-18-11-33(26(36)39-18)21-10-29-25-23(31-21)32-22(34)13-38-25/h7-8,10,14-15,18,28H,1-6,9,11-13H2,(H,30,35)(H,31,32,34)
• InChIKey: MJNLZYORJASEEH-UHFFFAOYSA-N
• XLogP: 1.64
• TPSA: 144.01 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 9
• Rotatable Bonds: 8
• Heavy Atoms: 39
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	540.55
LogP ≤ 5	1.64
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide?

The IUPAC name of N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide (CID 167514466) is N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide.

What is the SMILES notation for N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide?

The canonical SMILES for N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide is O=C1COc2ncc(N3CC(CCNCC4Cc5cc(NC(=O)C6CCOC6)cc(F)c5C4)OC3=O)nc2N1.

What is the InChIKey of N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide?

The InChIKey is MJNLZYORJASEEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29FN6O6/c27-20-8-17(30-24(35)15-2-4-37-12-15)7-16-5-14(6-19(16)20)9-28-3-1-18-11-33(26(36)39-18)21-10-29-25-23(31-21)32-22(34)13-38-25/h7-8,10,14-15,18,28H,1-6,9,11-13H2,(H,30,35)(H,31,32,34).

What are the key properties of N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide?

N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide has a molecular weight of 540.55 g/mol, XLogP of 1.64, 8 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for N-[7-fluoro-2-[[2-[2-oxo-3-(3-oxo-4H-pyrazino[2,3-b][1,4]oxazin-6-yl)-1,3-oxazolidin-5-yl]ethylamino]methyl]-2,3-dihydro-1H-inden-5-yl]oxolane-3-carboxamide is sourced from PubChem (CID 167514466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).