trimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane

C11H21NOSi — CID 67634794

IUPACtrimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane
SMILESC[Si](C)(C)OCCCCc1ccc[nH]1
InChIInChI=1S/C11H21NOSi/c1-14(2,3)13-10-5-4-7-11-8-6-9-12-11/h6,8-9,12H,4-5,7,10H2,1-3H3
InChIKeyHRUJHPZHWZCQJK-UHFFFAOYSA-N
MW211.38 g/mol
LogP3.19
Rot. Bonds6

About trimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane

trimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane (PubChem CID 67634794) has the molecular formula C11H21NOSi and a molecular weight of 211.38 g/mol. Its IUPAC name is trimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane.

Molecular Properties

Compound Nametrimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane
PubChem CID67634794
Molecular FormulaC11H21NOSi
Molecular Weight211.38 g/mol
Exact Mass211.14
IUPAC Nametrimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane
SMILESC[Si](C)(C)OCCCCc1ccc[nH]1
InChIInChI=1S/C11H21NOSi/c1-14(2,3)13-10-5-4-7-11-8-6-9-12-11/h6,8-9,12H,4-5,7,10H2,1-3H3
InChIKeyHRUJHPZHWZCQJK-UHFFFAOYSA-N
XLogP3.19
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.38
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane?
The IUPAC name of trimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane (CID 67634794) is trimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane.
What is the SMILES notation for trimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane?
The canonical SMILES for trimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane is C[Si](C)(C)OCCCCc1ccc[nH]1.
What is the InChIKey of trimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane?
The InChIKey is HRUJHPZHWZCQJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NOSi/c1-14(2,3)13-10-5-4-7-11-8-6-9-12-11/h6,8-9,12H,4-5,7,10H2,1-3H3.
What are the key properties of trimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane?
trimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane has a molecular weight of 211.38 g/mol, XLogP of 3.19, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[4-(1H-pyrrol-2-yl)butoxy]silane is sourced from PubChem (CID 67634794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).