[1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane

C30H46OSi — CID 58630452

IUPAC[1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane
SMILESC=CC[Si](OC1CC2C=CC=CC2C1CCC1C(C)CC2C=CC=CC21)(C(C)C)C(C)C
InChIInChI=1S/C30H46OSi/c1-7-18-32(21(2)3,22(4)5)31-30-20-25-13-9-11-15-28(25)29(30)17-16-26-23(6)19-24-12-8-10-14-27(24)26/h7-15,21-30H,1,16-20H2,2-6H3
InChIKeyBVWLYEJGBFXHOE-UHFFFAOYSA-N
MW450.78 g/mol
LogP8.50
Rot. Bonds9

About [1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane

[1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane (PubChem CID 58630452) has the molecular formula C30H46OSi and a molecular weight of 450.78 g/mol. Its IUPAC name is [1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane.

Molecular Properties

Compound Name[1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane
PubChem CID58630452
Molecular FormulaC30H46OSi
Molecular Weight450.78 g/mol
Exact Mass450.33
IUPAC Name[1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane
SMILESC=CC[Si](OC1CC2C=CC=CC2C1CCC1C(C)CC2C=CC=CC21)(C(C)C)C(C)C
InChIInChI=1S/C30H46OSi/c1-7-18-32(21(2)3,22(4)5)31-30-20-25-13-9-11-15-28(25)29(30)17-16-26-23(6)19-24-12-8-10-14-27(24)26/h7-15,21-30H,1,16-20H2,2-6H3
InChIKeyBVWLYEJGBFXHOE-UHFFFAOYSA-N
XLogP8.50
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500450.78
LogP ≤ 58.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze [1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane 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 [1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane?
The IUPAC name of [1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane (CID 58630452) is [1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane.
What is the SMILES notation for [1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane?
The canonical SMILES for [1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane is C=CC[Si](OC1CC2C=CC=CC2C1CCC1C(C)CC2C=CC=CC21)(C(C)C)C(C)C.
What is the InChIKey of [1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane?
The InChIKey is BVWLYEJGBFXHOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H46OSi/c1-7-18-32(21(2)3,22(4)5)31-30-20-25-13-9-11-15-28(25)29(30)17-16-26-23(6)19-24-12-8-10-14-27(24)26/h7-15,21-30H,1,16-20H2,2-6H3.
What are the key properties of [1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane?
[1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane has a molecular weight of 450.78 g/mol, XLogP of 8.50, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)ethyl]-2,3,3a,7a-tetrahydro-1H-inden-2-yl]oxy-di(propan-2-yl)-prop-2-enylsilane is sourced from PubChem (CID 58630452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).