2-methylsilylacetamide

C3H9NOSi — CID 123157412

IUPAC2-methylsilylacetamide
SMILESC[SiH2]CC(N)=O
InChIInChI=1S/C3H9NOSi/c1-6-2-3(4)5/h2,6H2,1H3,(H2,4,5)
InChIKeyYRSRARWDRPLZFZ-UHFFFAOYSA-N
MW103.20 g/mol
LogP-0.89
Rot. Bonds2

About 2-methylsilylacetamide

2-methylsilylacetamide (PubChem CID 123157412) has the molecular formula C3H9NOSi and a molecular weight of 103.20 g/mol. Its IUPAC name is 2-methylsilylacetamide.

Molecular Properties

Compound Name2-methylsilylacetamide
PubChem CID123157412
Molecular FormulaC3H9NOSi
Molecular Weight103.20 g/mol
Exact Mass103.05
IUPAC Name2-methylsilylacetamide
SMILESC[SiH2]CC(N)=O
InChIInChI=1S/C3H9NOSi/c1-6-2-3(4)5/h2,6H2,1H3,(H2,4,5)
InChIKeyYRSRARWDRPLZFZ-UHFFFAOYSA-N
XLogP-0.89
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.20
LogP ≤ 5-0.89
H-Bond Donors ≤ 51
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 2-methylsilylacetamide?
The IUPAC name of 2-methylsilylacetamide (CID 123157412) is 2-methylsilylacetamide.
What is the SMILES notation for 2-methylsilylacetamide?
The canonical SMILES for 2-methylsilylacetamide is C[SiH2]CC(N)=O.
What is the InChIKey of 2-methylsilylacetamide?
The InChIKey is YRSRARWDRPLZFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NOSi/c1-6-2-3(4)5/h2,6H2,1H3,(H2,4,5).
What are the key properties of 2-methylsilylacetamide?
2-methylsilylacetamide has a molecular weight of 103.20 g/mol, XLogP of -0.89, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylsilylacetamide is sourced from PubChem (CID 123157412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).