[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane

C71H124Si2 — CID 166038573

IUPAC[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane
SMILESCC(C)C1CC2C(CCCCCC3CCCC4C3CC(C)C4[Si](C)(C)C3C(C)CC4C(C5CCCC6CCCCC65)CCCC43)CCCC2C1[Si](C)(C)C1C(C)CC2C(C3CCCC4CCCCC43)CCCC21
InChIInChI=1S/C71H124Si2/c1-45(2)63-44-65-52(30-20-38-60(65)71(63)73(8,9)70-48(5)43-67-58(36-22-40-62(67)70)56-34-18-28-50-26-14-16-32-54(50)56)24-12-10-11-23-51-29-19-37-59-64(51)41-46(3)68(59)72(6,7)69-47(4)42-66-57(35-21-39-61(66)69)55-33-17-27-49-25-13-15-31-53(49)55/h45-71H,10-44H2,1-9H3
InChIKeyGSSYPQQGPVUOIH-UHFFFAOYSA-N
MW1033.94 g/mol
LogP21.97
Rot. Bonds13

About [4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane

[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane (PubChem CID 166038573) has the molecular formula C71H124Si2 and a molecular weight of 1033.94 g/mol. Its IUPAC name is [4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane.

Molecular Properties

Compound Name[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane
PubChem CID166038573
Molecular FormulaC71H124Si2
Molecular Weight1033.94 g/mol
Exact Mass1032.92
IUPAC Name[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane
SMILESCC(C)C1CC2C(CCCCCC3CCCC4C3CC(C)C4[Si](C)(C)C3C(C)CC4C(C5CCCC6CCCCC65)CCCC43)CCCC2C1[Si](C)(C)C1C(C)CC2C(C3CCCC4CCCCC43)CCCC21
InChIInChI=1S/C71H124Si2/c1-45(2)63-44-65-52(30-20-38-60(65)71(63)73(8,9)70-48(5)43-67-58(36-22-40-62(67)70)56-34-18-28-50-26-14-16-32-54(50)56)24-12-10-11-23-51-29-19-37-59-64(51)41-46(3)68(59)72(6,7)69-47(4)42-66-57(35-21-39-61(66)69)55-33-17-27-49-25-13-15-31-53(49)55/h45-71H,10-44H2,1-9H3
InChIKeyGSSYPQQGPVUOIH-UHFFFAOYSA-N
XLogP21.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds13
Heavy Atoms73
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001033.94
LogP ≤ 521.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze [4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane with MolForge

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Frequently Asked Questions

What is the IUPAC name of [4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane?
The IUPAC name of [4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane (CID 166038573) is [4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane.
What is the SMILES notation for [4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane?
The canonical SMILES for [4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane is CC(C)C1CC2C(CCCCCC3CCCC4C3CC(C)C4[Si](C)(C)C3C(C)CC4C(C5CCCC6CCCCC65)CCCC43)CCCC2C1[Si](C)(C)C1C(C)CC2C(C3CCCC4CCCCC43)CCCC21.
What is the InChIKey of [4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane?
The InChIKey is GSSYPQQGPVUOIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C71H124Si2/c1-45(2)63-44-65-52(30-20-38-60(65)71(63)73(8,9)70-48(5)43-67-58(36-22-40-62(67)70)56-34-18-28-50-26-14-16-32-54(50)56)24-12-10-11-23-51-29-19-37-59-64(51)41-46(3)68(59)72(6,7)69-47(4)42-66-57(35-21-39-61(66)69)55-33-17-27-49-25-13-15-31-53(49)55/h45-71H,10-44H2,1-9H3.
What are the key properties of [4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane?
[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane has a molecular weight of 1033.94 g/mol, XLogP of 21.97, 13 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-[4-[5-[1-[[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethylsilane is sourced from PubChem (CID 166038573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).