1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one

C8H12BrNOSi — CID 15448274

IUPAC1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one
SMILESC[Si](C)(Br)Cn1ccccc1=O
InChIInChI=1S/C8H12BrNOSi/c1-12(2,9)7-10-6-4-3-5-8(10)11/h3-6H,7H2,1-2H3
InChIKeyMFKKFZGHKRXZSB-UHFFFAOYSA-N
MW246.18 g/mol
LogP1.99
Rot. Bonds2

About 1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one

1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one (PubChem CID 15448274) has the molecular formula C8H12BrNOSi and a molecular weight of 246.18 g/mol. Its IUPAC name is 1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one.

Molecular Properties

Compound Name1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one
PubChem CID15448274
Molecular FormulaC8H12BrNOSi
Molecular Weight246.18 g/mol
Exact Mass244.99
IUPAC Name1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one
SMILESC[Si](C)(Br)Cn1ccccc1=O
InChIInChI=1S/C8H12BrNOSi/c1-12(2,9)7-10-6-4-3-5-8(10)11/h3-6H,7H2,1-2H3
InChIKeyMFKKFZGHKRXZSB-UHFFFAOYSA-N
XLogP1.99
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.18
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one?
The IUPAC name of 1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one (CID 15448274) is 1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one.
What is the SMILES notation for 1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one?
The canonical SMILES for 1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one is C[Si](C)(Br)Cn1ccccc1=O.
What is the InChIKey of 1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one?
The InChIKey is MFKKFZGHKRXZSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12BrNOSi/c1-12(2,9)7-10-6-4-3-5-8(10)11/h3-6H,7H2,1-2H3.
What are the key properties of 1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one?
1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one has a molecular weight of 246.18 g/mol, XLogP of 1.99, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[bromo(dimethyl)silyl]methyl]pyridin-2-one is sourced from PubChem (CID 15448274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).