[(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane

C21H42O2Si2 — CID 11111750

IUPAC[(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane
SMILESCC1=CC[C@@]2(C(O[Si](C)(C)C)C1)[C@H](C)CC[C@@H]2C(C)(C)O[Si](C)(C)C
InChIInChI=1S/C21H42O2Si2/c1-16-13-14-21(19(15-16)22-24(5,6)7)17(2)11-12-18(21)20(3,4)23-25(8,9)10/h13,17-19H,11-12,14-15H2,1-10H3/t17-,18-,19?,21-/m1/s1
InChIKeyCODRBXJBCOXYMJ-KNLKJWTQSA-N
MW382.74 g/mol
LogP6.61
Rot. Bonds5

About [(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane

[(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane (PubChem CID 11111750) has the molecular formula C21H42O2Si2 and a molecular weight of 382.74 g/mol. Its IUPAC name is [(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane
PubChem CID11111750
Molecular FormulaC21H42O2Si2
Molecular Weight382.74 g/mol
Exact Mass382.27
IUPAC Name[(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane
SMILESCC1=CC[C@@]2(C(O[Si](C)(C)C)C1)[C@H](C)CC[C@@H]2C(C)(C)O[Si](C)(C)C
InChIInChI=1S/C21H42O2Si2/c1-16-13-14-21(19(15-16)22-24(5,6)7)17(2)11-12-18(21)20(3,4)23-25(8,9)10/h13,17-19H,11-12,14-15H2,1-10H3/t17-,18-,19?,21-/m1/s1
InChIKeyCODRBXJBCOXYMJ-KNLKJWTQSA-N
XLogP6.61
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.74
LogP ≤ 56.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane 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 [(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane?
The IUPAC name of [(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane (CID 11111750) is [(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane.
What is the SMILES notation for [(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane?
The canonical SMILES for [(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane is CC1=CC[C@@]2(C(O[Si](C)(C)C)C1)[C@H](C)CC[C@@H]2C(C)(C)O[Si](C)(C)C.
What is the InChIKey of [(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane?
The InChIKey is CODRBXJBCOXYMJ-KNLKJWTQSA-N. The full InChI is InChI=1S/C21H42O2Si2/c1-16-13-14-21(19(15-16)22-24(5,6)7)17(2)11-12-18(21)20(3,4)23-25(8,9)10/h13,17-19H,11-12,14-15H2,1-10H3/t17-,18-,19?,21-/m1/s1.
What are the key properties of [(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane?
[(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane has a molecular weight of 382.74 g/mol, XLogP of 6.61, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,4S,5R)-1,8-dimethyl-4-(2-trimethylsilyloxypropan-2-yl)spiro[4.5]dec-7-en-10-yl]oxy-trimethylsilane is sourced from PubChem (CID 11111750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).