(3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one

C12H28N2OSi2 — CID 90425260

IUPAC(3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one
SMILESCC1(C)[C@@H](N)C(=O)N1C([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C12H28N2OSi2/c1-12(2)9(13)10(15)14(12)11(16(3,4)5)17(6,7)8/h9,11H,13H2,1-8H3/t9-/m0/s1
InChIKeyVKQCTQQZNQTXFC-VIFPVBQESA-N
MW272.54 g/mol
LogP2.06
Rot. Bonds3

About (3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one

(3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one (PubChem CID 90425260) has the molecular formula C12H28N2OSi2 and a molecular weight of 272.54 g/mol. Its IUPAC name is (3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one.

Molecular Properties

Compound Name(3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one
PubChem CID90425260
Molecular FormulaC12H28N2OSi2
Molecular Weight272.54 g/mol
Exact Mass272.17
IUPAC Name(3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one
SMILESCC1(C)[C@@H](N)C(=O)N1C([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C12H28N2OSi2/c1-12(2)9(13)10(15)14(12)11(16(3,4)5)17(6,7)8/h9,11H,13H2,1-8H3/t9-/m0/s1
InChIKeyVKQCTQQZNQTXFC-VIFPVBQESA-N
XLogP2.06
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.54
LogP ≤ 52.06
H-Bond Donors ≤ 51
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 (3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one?
The IUPAC name of (3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one (CID 90425260) is (3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one.
What is the SMILES notation for (3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one?
The canonical SMILES for (3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one is CC1(C)[C@@H](N)C(=O)N1C([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of (3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one?
The InChIKey is VKQCTQQZNQTXFC-VIFPVBQESA-N. The full InChI is InChI=1S/C12H28N2OSi2/c1-12(2)9(13)10(15)14(12)11(16(3,4)5)17(6,7)8/h9,11H,13H2,1-8H3/t9-/m0/s1.
What are the key properties of (3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one?
(3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one has a molecular weight of 272.54 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-1-[bis(trimethylsilyl)methyl]-4,4-dimethylazetidin-2-one is sourced from PubChem (CID 90425260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).