tert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane

C15H26N2OSi — CID 141180925

IUPACtert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane
SMILESCC(C)(C)[Si](C)(C)O[C@H]1CCN(c2ccccn2)C1
InChIInChI=1S/C15H26N2OSi/c1-15(2,3)19(4,5)18-13-9-11-17(12-13)14-8-6-7-10-16-14/h6-8,10,13H,9,11-12H2,1-5H3/t13-/m0/s1
InChIKeyWTWZZENNBIWEHD-ZDUSSCGKSA-N
MW278.47 g/mol
LogP3.68
Rot. Bonds3

About tert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane

tert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane (PubChem CID 141180925) has the molecular formula C15H26N2OSi and a molecular weight of 278.47 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane
PubChem CID141180925
Molecular FormulaC15H26N2OSi
Molecular Weight278.47 g/mol
Exact Mass278.18
IUPAC Nametert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane
SMILESCC(C)(C)[Si](C)(C)O[C@H]1CCN(c2ccccn2)C1
InChIInChI=1S/C15H26N2OSi/c1-15(2,3)19(4,5)18-13-9-11-17(12-13)14-8-6-7-10-16-14/h6-8,10,13H,9,11-12H2,1-5H3/t13-/m0/s1
InChIKeyWTWZZENNBIWEHD-ZDUSSCGKSA-N
XLogP3.68
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.47
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 tert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane (CID 141180925) is tert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane is CC(C)(C)[Si](C)(C)O[C@H]1CCN(c2ccccn2)C1.
What is the InChIKey of tert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane?
The InChIKey is WTWZZENNBIWEHD-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H26N2OSi/c1-15(2,3)19(4,5)18-13-9-11-17(12-13)14-8-6-7-10-16-14/h6-8,10,13H,9,11-12H2,1-5H3/t13-/m0/s1.
What are the key properties of tert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane?
tert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane has a molecular weight of 278.47 g/mol, XLogP of 3.68, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]oxysilane is sourced from PubChem (CID 141180925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).