5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one

C11H18OSi — CID 14416789

IUPAC5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one
SMILESCC1=C([Si](C)(C)C)C(=O)C2(CC2)C1
InChIInChI=1S/C11H18OSi/c1-8-7-11(5-6-11)10(12)9(8)13(2,3)4/h5-7H2,1-4H3
InChIKeyMFISYGAOTIQTSJ-UHFFFAOYSA-N
MW194.35 g/mol
LogP2.93
Rot. Bonds1

About 5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one

5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one (PubChem CID 14416789) has the molecular formula C11H18OSi and a molecular weight of 194.35 g/mol. Its IUPAC name is 5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one.

Molecular Properties

Compound Name5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one
PubChem CID14416789
Molecular FormulaC11H18OSi
Molecular Weight194.35 g/mol
Exact Mass194.11
IUPAC Name5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one
SMILESCC1=C([Si](C)(C)C)C(=O)C2(CC2)C1
InChIInChI=1S/C11H18OSi/c1-8-7-11(5-6-11)10(12)9(8)13(2,3)4/h5-7H2,1-4H3
InChIKeyMFISYGAOTIQTSJ-UHFFFAOYSA-N
XLogP2.93
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.35
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one with MolForge

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

Launch Full Analysis

Related Compounds

2-Cyclopenten-1-one, 3-methyl-2-(trimethylsilyl)-
CID 592669
1-[(1R,5S)-1,2,5-trimethyl-3-trimethylsilylcyclopent-2-en-1-yl]ethanone
CID 13095616
1-[(1R,5R)-1,2,5-trimethyl-3-trimethylsilylcyclopent-2-en-1-yl]ethanone
CID 13095617
3,4-Dimethyl-2-tri(propan-2-yl)silylcyclopent-2-en-1-one
CID 15828916
3,4,5,5-Tetramethyl-2-tri(propan-2-yl)silylcyclopent-2-en-1-one
CID 15828918
2,6,6-Trimethyl-3-(trimethylsilylmethyl)hept-2-en-4-one
CID 85878078
2,2,5-Trimethyl-4-(trimethylsilylmethyl)hex-4-en-3-one
CID 85878082
6-Methyl-3-(trimethylsilyl)spiro[4.5]deca-2,6-dien-1-one
CID 12815537
6-Methyl-2-(trimethylsilyl)spiro[4.4]nona-2,6-dien-1-one
CID 13128966
6-Methyl-3-(trimethylsilyl)spiro[4.4]nona-2,6-dien-1-one
CID 13128967
3,6-Dimethyl-2-(trimethylsilyl)spiro[4.4]nona-2,6-dien-1-one
CID 13128968
1-(3,3-Dimethyl-2-trimethylsilylcyclopropen-1-yl)propan-1-one
CID 10965456

Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one?
The IUPAC name of 5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one (CID 14416789) is 5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one.
What is the SMILES notation for 5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one?
The canonical SMILES for 5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one is CC1=C([Si](C)(C)C)C(=O)C2(CC2)C1.
What is the InChIKey of 5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one?
The InChIKey is MFISYGAOTIQTSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18OSi/c1-8-7-11(5-6-11)10(12)9(8)13(2,3)4/h5-7H2,1-4H3.
What are the key properties of 5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one?
5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one has a molecular weight of 194.35 g/mol, XLogP of 2.93, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-trimethylsilylspiro[2.4]hept-5-en-7-one is sourced from PubChem (CID 14416789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).