9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol

C21H32O2Si — CID 14985556

IUPAC9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol
SMILESCC[Si](CC)(CC)OC1C#CCC2(O)CCC=C2C#CC(C)(C)C1
InChIInChI=1S/C21H32O2Si/c1-6-24(7-2,8-3)23-19-12-10-15-21(22)14-9-11-18(21)13-16-20(4,5)17-19/h11,19,22H,6-9,14-15,17H2,1-5H3
InChIKeyWHOSDHGQXGGJFX-UHFFFAOYSA-N
MW344.57 g/mol
LogP4.65
Rot. Bonds5

About 9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol

9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol (PubChem CID 14985556) has the molecular formula C21H32O2Si and a molecular weight of 344.57 g/mol. Its IUPAC name is 9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol.

Molecular Properties

Compound Name9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol
PubChem CID14985556
Molecular FormulaC21H32O2Si
Molecular Weight344.57 g/mol
Exact Mass344.22
IUPAC Name9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol
SMILESCC[Si](CC)(CC)OC1C#CCC2(O)CCC=C2C#CC(C)(C)C1
InChIInChI=1S/C21H32O2Si/c1-6-24(7-2,8-3)23-19-12-10-15-21(22)14-9-11-18(21)13-16-20(4,5)17-19/h11,19,22H,6-9,14-15,17H2,1-5H3
InChIKeyWHOSDHGQXGGJFX-UHFFFAOYSA-N
XLogP4.65
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.57
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol 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-Bromo-1-(6,6-dimethyl-8-tributylstannyl-4-triethylsilyloxyocta-2,7-diynyl)cyclopent-2-en-1-ol
CID 14985555
1-(4-Hydroxypent-2-ynyl)-2-(2-trimethylsilylethynyl)cyclopent-2-en-1-ol
CID 85618202
(1S,4S)-1-tert-butyl-4-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopent-2-en-1-ol
CID 138969078
2-[tert-butyl(dimethyl)silyl]oxy-9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol
CID 15233711
2,5,5-trimethyl-1-[(E)-3-methyl-5-trimethylsilyloxypent-3-en-1-ynyl]-4-trimethylsilyloxycyclopent-2-en-1-ol
CID 20340080
5-[2,5,5-Trimethyl-1-hydroxy-4-[(trimethylsilyl)oxy]-cyclopent-2-en-1-yl]-3-methyl-1-[(trimethylsilyl)oxy]-pent-2-en-4-yne
CID 54234765
(1RS,4RS)-4-hydroxy-4-(3-trimethylsilyl-2-propynyl)-2-cyclopenten-1-yl (t-butyldimethylsilyl) ether
CID 86754280
2-[tert-butyl(dimethyl)silyl]oxy-9,9-dimethyl-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulene-3a,7-diol
CID 88489575
9,9-dimethyl-7-triethylsilyloxy-2-(2-triethylsilyloxyethyl)-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol
CID 139755705

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol?
The IUPAC name of 9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol (CID 14985556) is 9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol.
What is the SMILES notation for 9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol?
The canonical SMILES for 9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol is CC[Si](CC)(CC)OC1C#CCC2(O)CCC=C2C#CC(C)(C)C1.
What is the InChIKey of 9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol?
The InChIKey is WHOSDHGQXGGJFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H32O2Si/c1-6-24(7-2,8-3)23-19-12-10-15-21(22)14-9-11-18(21)13-16-20(4,5)17-19/h11,19,22H,6-9,14-15,17H2,1-5H3.
What are the key properties of 9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol?
9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol has a molecular weight of 344.57 g/mol, XLogP of 4.65, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-7-triethylsilyloxy-5,6,10,11-tetradehydro-3,4,7,8-tetrahydro-2H-cyclopenta[10]annulen-3a-ol is sourced from PubChem (CID 14985556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).