tert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane

C16H28N2OSi — CID 132596656

IUPACtert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane
SMILESCC(C)(C)[Si](C)(C)OC(c1ccccn1)[C@@H]1CCCN1
InChIInChI=1S/C16H28N2OSi/c1-16(2,3)20(4,5)19-15(14-10-8-12-18-14)13-9-6-7-11-17-13/h6-7,9,11,14-15,18H,8,10,12H2,1-5H3/t14-,15?/m0/s1
InChIKeyMJOGKBZRJRBNKD-MLCCFXAWSA-N
MW292.50 g/mol
LogP3.90
Rot. Bonds4

About tert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane

tert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane (PubChem CID 132596656) has the molecular formula C16H28N2OSi and a molecular weight of 292.50 g/mol. Its IUPAC name is tert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane
PubChem CID132596656
Molecular FormulaC16H28N2OSi
Molecular Weight292.50 g/mol
Exact Mass292.20
IUPAC Nametert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane
SMILESCC(C)(C)[Si](C)(C)OC(c1ccccn1)[C@@H]1CCCN1
InChIInChI=1S/C16H28N2OSi/c1-16(2,3)20(4,5)19-15(14-10-8-12-18-14)13-9-6-7-11-17-13/h6-7,9,11,14-15,18H,8,10,12H2,1-5H3/t14-,15?/m0/s1
InChIKeyMJOGKBZRJRBNKD-MLCCFXAWSA-N
XLogP3.90
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.50
LogP ≤ 53.90
H-Bond Donors ≤ 51
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-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane (CID 132596656) is tert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane is CC(C)(C)[Si](C)(C)OC(c1ccccn1)[C@@H]1CCCN1.
What is the InChIKey of tert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane?
The InChIKey is MJOGKBZRJRBNKD-MLCCFXAWSA-N. The full InChI is InChI=1S/C16H28N2OSi/c1-16(2,3)20(4,5)19-15(14-10-8-12-18-14)13-9-6-7-11-17-13/h6-7,9,11,14-15,18H,8,10,12H2,1-5H3/t14-,15?/m0/s1.
What are the key properties of tert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane?
tert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane has a molecular weight of 292.50 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[pyridin-2-yl-[(2S)-pyrrolidin-2-yl]methoxy]silane is sourced from PubChem (CID 132596656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).