1-benzyl-4-trimethylsilylazetidin-2-one

C13H19NOSi — CID 10263412

IUPAC1-benzyl-4-trimethylsilylazetidin-2-one
SMILESC[Si](C)(C)C1CC(=O)N1Cc1ccccc1
InChIInChI=1S/C13H19NOSi/c1-16(2,3)13-9-12(15)14(13)10-11-7-5-4-6-8-11/h4-8,13H,9-10H2,1-3H3
InChIKeyAUKYCLKRXVWLBX-UHFFFAOYSA-N
MW233.39 g/mol
LogP2.66
Rot. Bonds3

About 1-benzyl-4-trimethylsilylazetidin-2-one

1-benzyl-4-trimethylsilylazetidin-2-one (PubChem CID 10263412) has the molecular formula C13H19NOSi and a molecular weight of 233.39 g/mol. Its IUPAC name is 1-benzyl-4-trimethylsilylazetidin-2-one.

Molecular Properties

Compound Name1-benzyl-4-trimethylsilylazetidin-2-one
PubChem CID10263412
Molecular FormulaC13H19NOSi
Molecular Weight233.39 g/mol
Exact Mass233.12
IUPAC Name1-benzyl-4-trimethylsilylazetidin-2-one
SMILESC[Si](C)(C)C1CC(=O)N1Cc1ccccc1
InChIInChI=1S/C13H19NOSi/c1-16(2,3)13-9-12(15)14(13)10-11-7-5-4-6-8-11/h4-8,13H,9-10H2,1-3H3
InChIKeyAUKYCLKRXVWLBX-UHFFFAOYSA-N
XLogP2.66
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.39
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1-benzyl-4-trimethylsilylazetidin-2-one?
The IUPAC name of 1-benzyl-4-trimethylsilylazetidin-2-one (CID 10263412) is 1-benzyl-4-trimethylsilylazetidin-2-one.
What is the SMILES notation for 1-benzyl-4-trimethylsilylazetidin-2-one?
The canonical SMILES for 1-benzyl-4-trimethylsilylazetidin-2-one is C[Si](C)(C)C1CC(=O)N1Cc1ccccc1.
What is the InChIKey of 1-benzyl-4-trimethylsilylazetidin-2-one?
The InChIKey is AUKYCLKRXVWLBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NOSi/c1-16(2,3)13-9-12(15)14(13)10-11-7-5-4-6-8-11/h4-8,13H,9-10H2,1-3H3.
What are the key properties of 1-benzyl-4-trimethylsilylazetidin-2-one?
1-benzyl-4-trimethylsilylazetidin-2-one has a molecular weight of 233.39 g/mol, XLogP of 2.66, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-4-trimethylsilylazetidin-2-one is sourced from PubChem (CID 10263412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).