(2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one

C14H24N2OSi — CID 132916206

IUPAC(2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one
SMILESCC1(C)C2CC1[C@@]1(C)C([Si](C)(C)C)=NN[C@H]1C2=O
InChIInChI=1S/C14H24N2OSi/c1-13(2)8-7-9(13)14(3)11(10(8)17)15-16-12(14)18(4,5)6/h8-9,11,15H,7H2,1-6H3/t8?,9?,11-,14+/m0/s1
InChIKeyUWVQFBNVURICMO-HDOXWXFPSA-N
MW264.44 g/mol
LogP2.44
Rot. Bonds1

About (2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one

(2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one (PubChem CID 132916206) has the molecular formula C14H24N2OSi and a molecular weight of 264.44 g/mol. Its IUPAC name is (2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one.

Molecular Properties

Compound Name(2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one
PubChem CID132916206
Molecular FormulaC14H24N2OSi
Molecular Weight264.44 g/mol
Exact Mass264.17
IUPAC Name(2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one
SMILESCC1(C)C2CC1[C@@]1(C)C([Si](C)(C)C)=NN[C@H]1C2=O
InChIInChI=1S/C14H24N2OSi/c1-13(2)8-7-9(13)14(3)11(10(8)17)15-16-12(14)18(4,5)6/h8-9,11,15H,7H2,1-6H3/t8?,9?,11-,14+/m0/s1
InChIKeyUWVQFBNVURICMO-HDOXWXFPSA-N
XLogP2.44
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 (2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one?
The IUPAC name of (2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one (CID 132916206) is (2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one.
What is the SMILES notation for (2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one?
The canonical SMILES for (2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one is CC1(C)C2CC1[C@@]1(C)C([Si](C)(C)C)=NN[C@H]1C2=O.
What is the InChIKey of (2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one?
The InChIKey is UWVQFBNVURICMO-HDOXWXFPSA-N. The full InChI is InChI=1S/C14H24N2OSi/c1-13(2)8-7-9(13)14(3)11(10(8)17)15-16-12(14)18(4,5)6/h8-9,11,15H,7H2,1-6H3/t8?,9?,11-,14+/m0/s1.
What are the key properties of (2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one?
(2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one has a molecular weight of 264.44 g/mol, XLogP of 2.44, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6R)-2,9,9-trimethyl-3-trimethylsilyl-4,5-diazatricyclo[6.1.1.02,6]dec-3-en-7-one is sourced from PubChem (CID 132916206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).