5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one

C10H19NO2Si — CID 139239439

IUPAC5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one
SMILESCC1([Si](C)(C)CCCN)C=CC(=O)O1
InChIInChI=1S/C10H19NO2Si/c1-10(6-5-9(12)13-10)14(2,3)8-4-7-11/h5-6H,4,7-8,11H2,1-3H3
InChIKeyXTTPRIRLLXLJQM-UHFFFAOYSA-N
MW213.35 g/mol
LogP1.45
Rot. Bonds4

About 5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one

5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one (PubChem CID 139239439) has the molecular formula C10H19NO2Si and a molecular weight of 213.35 g/mol. Its IUPAC name is 5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one.

Molecular Properties

Compound Name5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one
PubChem CID139239439
Molecular FormulaC10H19NO2Si
Molecular Weight213.35 g/mol
Exact Mass213.12
IUPAC Name5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one
SMILESCC1([Si](C)(C)CCCN)C=CC(=O)O1
InChIInChI=1S/C10H19NO2Si/c1-10(6-5-9(12)13-10)14(2,3)8-4-7-11/h5-6H,4,7-8,11H2,1-3H3
InChIKeyXTTPRIRLLXLJQM-UHFFFAOYSA-N
XLogP1.45
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.35
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one?
The IUPAC name of 5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one (CID 139239439) is 5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one.
What is the SMILES notation for 5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one?
The canonical SMILES for 5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one is CC1([Si](C)(C)CCCN)C=CC(=O)O1.
What is the InChIKey of 5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one?
The InChIKey is XTTPRIRLLXLJQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2Si/c1-10(6-5-9(12)13-10)14(2,3)8-4-7-11/h5-6H,4,7-8,11H2,1-3H3.
What are the key properties of 5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one?
5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one has a molecular weight of 213.35 g/mol, XLogP of 1.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-aminopropyl(dimethyl)silyl]-5-methylfuran-2-one is sourced from PubChem (CID 139239439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).