2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one

C10H17NO2Si — CID 10330796

IUPAC2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one
SMILESC[Si](C)(C)C1=CCN2C(=O)CCC2O1
InChIInChI=1S/C10H17NO2Si/c1-14(2,3)10-6-7-11-8(12)4-5-9(11)13-10/h6,9H,4-5,7H2,1-3H3
InChIKeyJUUAMDHCEYQNSW-UHFFFAOYSA-N
MW211.34 g/mol
LogP1.73
Rot. Bonds1

About 2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one

2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one (PubChem CID 10330796) has the molecular formula C10H17NO2Si and a molecular weight of 211.34 g/mol. Its IUPAC name is 2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one.

Molecular Properties

Compound Name2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one
PubChem CID10330796
Molecular FormulaC10H17NO2Si
Molecular Weight211.34 g/mol
Exact Mass211.10
IUPAC Name2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one
SMILESC[Si](C)(C)C1=CCN2C(=O)CCC2O1
InChIInChI=1S/C10H17NO2Si/c1-14(2,3)10-6-7-11-8(12)4-5-9(11)13-10/h6,9H,4-5,7H2,1-3H3
InChIKeyJUUAMDHCEYQNSW-UHFFFAOYSA-N
XLogP1.73
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.34
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one?
The IUPAC name of 2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one (CID 10330796) is 2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one.
What is the SMILES notation for 2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one?
The canonical SMILES for 2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one is C[Si](C)(C)C1=CCN2C(=O)CCC2O1.
What is the InChIKey of 2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one?
The InChIKey is JUUAMDHCEYQNSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2Si/c1-14(2,3)10-6-7-11-8(12)4-5-9(11)13-10/h6,9H,4-5,7H2,1-3H3.
What are the key properties of 2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one?
2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one has a molecular weight of 211.34 g/mol, XLogP of 1.73, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-trimethylsilyl-4,7,8,8a-tetrahydropyrrolo[2,1-b][1,3]oxazin-6-one is sourced from PubChem (CID 10330796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).