tri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane

C22H45NO2Si2 — CID 15325872

IUPACtri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane
SMILESCC(C)[Si](Oc1ccc(O[Si](C(C)C)(C(C)C)C(C)C)[nH]1)(C(C)C)C(C)C
InChIInChI=1S/C22H45NO2Si2/c1-15(2)26(16(3)4,17(5)6)24-21-13-14-22(23-21)25-27(18(7)8,19(9)10)20(11)12/h13-20,23H,1-12H3
InChIKeyWPRVCXZDQNMFTH-UHFFFAOYSA-N
MW411.78 g/mol
LogP8.12
Rot. Bonds10

About tri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane

tri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane (PubChem CID 15325872) has the molecular formula C22H45NO2Si2 and a molecular weight of 411.78 g/mol. Its IUPAC name is tri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane.

Molecular Properties

Compound Nametri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane
PubChem CID15325872
Molecular FormulaC22H45NO2Si2
Molecular Weight411.78 g/mol
Exact Mass411.30
IUPAC Nametri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane
SMILESCC(C)[Si](Oc1ccc(O[Si](C(C)C)(C(C)C)C(C)C)[nH]1)(C(C)C)C(C)C
InChIInChI=1S/C22H45NO2Si2/c1-15(2)26(16(3)4,17(5)6)24-21-13-14-22(23-21)25-27(18(7)8,19(9)10)20(11)12/h13-20,23H,1-12H3
InChIKeyWPRVCXZDQNMFTH-UHFFFAOYSA-N
XLogP8.12
TPSA34.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500411.78
LogP ≤ 58.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane?
The IUPAC name of tri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane (CID 15325872) is tri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane.
What is the SMILES notation for tri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane?
The canonical SMILES for tri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane is CC(C)[Si](Oc1ccc(O[Si](C(C)C)(C(C)C)C(C)C)[nH]1)(C(C)C)C(C)C.
What is the InChIKey of tri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane?
The InChIKey is WPRVCXZDQNMFTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H45NO2Si2/c1-15(2)26(16(3)4,17(5)6)24-21-13-14-22(23-21)25-27(18(7)8,19(9)10)20(11)12/h13-20,23H,1-12H3.
What are the key properties of tri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane?
tri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane has a molecular weight of 411.78 g/mol, XLogP of 8.12, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yl)-[[5-tri(propan-2-yl)silyloxy-1H-pyrrol-2-yl]oxy]silane is sourced from PubChem (CID 15325872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).