[1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide

C32H41FN6O8 — CID 143585883

About [1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide

[1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide (PubChem CID 143585883) has the molecular formula C32H41FN6O8 and a molecular weight of 656.71 g/mol. Its IUPAC name is [1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide.

Molecular Properties

• Compound Name: [1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide
• PubChem CID: 143585883
• Molecular Formula: C32H41FN6O8
• Molecular Weight: 656.71 g/mol
• Exact Mass: 656.30
• IUPAC Name: [1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide
• SMILES: CCCC(=O)OC(CC1CC(c2ccc(-c3ccc(N4CC(CNC(C)=O)OC4=O)cc3F)cn2)=NO1)CN1CCOCC1.NC=O
• InChI: InChI=1S/C31H38FN5O7.CH3NO/c1-3-4-30(39)42-24(18-36-9-11-41-12-10-36)14-23-15-29(35-44-23)28-8-5-21(16-34-28)26-7-6-22(13-27(26)32)37-19-25(43-31(37)40)17-33-20(2)38;2-1-3/h5-8,13,16,23-25H,3-4,9-12,14-15,17-19H2,1-2H3,(H,33,38);1H,(H2,2,3)
• InChIKey: GLSDRGMQISUFAL-UHFFFAOYSA-N
• XLogP: 2.38
• TPSA: 174.98 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 11
• Rotatable Bonds: 12
• Heavy Atoms: 47
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	656.71
LogP ≤ 5	2.38
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide?

The IUPAC name of [1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide (CID 143585883) is [1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide.

What is the SMILES notation for [1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide?

The canonical SMILES for [1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide is CCCC(=O)OC(CC1CC(c2ccc(-c3ccc(N4CC(CNC(C)=O)OC4=O)cc3F)cn2)=NO1)CN1CCOCC1.NC=O.

What is the InChIKey of [1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide?

The InChIKey is GLSDRGMQISUFAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H38FN5O7.CH3NO/c1-3-4-30(39)42-24(18-36-9-11-41-12-10-36)14-23-15-29(35-44-23)28-8-5-21(16-34-28)26-7-6-22(13-27(26)32)37-19-25(43-31(37)40)17-33-20(2)38;2-1-3/h5-8,13,16,23-25H,3-4,9-12,14-15,17-19H2,1-2H3,(H,33,38);1H,(H2,2,3).

What are the key properties of [1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide?

[1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide has a molecular weight of 656.71 g/mol, XLogP of 2.38, 12 rotatable bonds, 2 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for [1-[3-[5-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-2-pyridinyl]-4,5-dihydro-1,2-oxazol-5-yl]-3-morpholin-4-ylpropan-2-yl] butanoate;formamide is sourced from PubChem (CID 143585883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).