trimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane

C26H47NOSiSn — CID 177464058

IUPACtrimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane
SMILESCCCC[Sn](CCCC)(CCCC)c1cn(COCC[Si](C)(C)C)c2ccccc12
InChIInChI=1S/C14H20NOSi.3C4H9.Sn/c1-17(2,3)11-10-16-12-15-9-8-13-6-4-5-7-14(13)15;3*1-3-4-2;/h4-7,9H,10-12H2,1-3H3;3*1,3-4H2,2H3;
InChIKeyAVUYBJOUSDSDSP-UHFFFAOYSA-N
MW536.47 g/mol
LogP8.01
Rot. Bonds15

About trimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane

trimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane (PubChem CID 177464058) has the molecular formula C26H47NOSiSn and a molecular weight of 536.47 g/mol. Its IUPAC name is trimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane
PubChem CID177464058
Molecular FormulaC26H47NOSiSn
Molecular Weight536.47 g/mol
Exact Mass537.24
IUPAC Nametrimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane
SMILESCCCC[Sn](CCCC)(CCCC)c1cn(COCC[Si](C)(C)C)c2ccccc12
InChIInChI=1S/C14H20NOSi.3C4H9.Sn/c1-17(2,3)11-10-16-12-15-9-8-13-6-4-5-7-14(13)15;3*1-3-4-2;/h4-7,9H,10-12H2,1-3H3;3*1,3-4H2,2H3;
InChIKeyAVUYBJOUSDSDSP-UHFFFAOYSA-N
XLogP8.01
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms30
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500536.47
LogP ≤ 58.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze trimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane 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 trimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane?
The IUPAC name of trimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane (CID 177464058) is trimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane.
What is the SMILES notation for trimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane?
The canonical SMILES for trimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane is CCCC[Sn](CCCC)(CCCC)c1cn(COCC[Si](C)(C)C)c2ccccc12.
What is the InChIKey of trimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane?
The InChIKey is AVUYBJOUSDSDSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20NOSi.3C4H9.Sn/c1-17(2,3)11-10-16-12-15-9-8-13-6-4-5-7-14(13)15;3*1-3-4-2;/h4-7,9H,10-12H2,1-3H3;3*1,3-4H2,2H3;.
What are the key properties of trimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane?
trimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane has a molecular weight of 536.47 g/mol, XLogP of 8.01, 15 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[(3-tributylstannylindol-1-yl)methoxy]ethyl]silane is sourced from PubChem (CID 177464058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).