tert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane

C11H24NOSi- — CID 91868284

IUPACtert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane
SMILESC[C@@H]1C[C@@H](O[Si](C)(C)C(C)(C)C)C[N-]1
InChIInChI=1S/C11H24NOSi/c1-9-7-10(8-12-9)13-14(5,6)11(2,3)4/h9-10H,7-8H2,1-6H3/q-1/t9-,10-/m1/s1
InChIKeyBFAVETVFNJMZLQ-NXEZZACHSA-N
MW214.40 g/mol
LogP3.54
Rot. Bonds2

About tert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane

tert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane (PubChem CID 91868284) has the molecular formula C11H24NOSi- and a molecular weight of 214.40 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane
PubChem CID91868284
Molecular FormulaC11H24NOSi-
Molecular Weight214.40 g/mol
Exact Mass214.16
IUPAC Nametert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane
SMILESC[C@@H]1C[C@@H](O[Si](C)(C)C(C)(C)C)C[N-]1
InChIInChI=1S/C11H24NOSi/c1-9-7-10(8-12-9)13-14(5,6)11(2,3)4/h9-10H,7-8H2,1-6H3/q-1/t9-,10-/m1/s1
InChIKeyBFAVETVFNJMZLQ-NXEZZACHSA-N
XLogP3.54
TPSA23.33 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.40
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane (CID 91868284) is tert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane is C[C@@H]1C[C@@H](O[Si](C)(C)C(C)(C)C)C[N-]1.
What is the InChIKey of tert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane?
The InChIKey is BFAVETVFNJMZLQ-NXEZZACHSA-N. The full InChI is InChI=1S/C11H24NOSi/c1-9-7-10(8-12-9)13-14(5,6)11(2,3)4/h9-10H,7-8H2,1-6H3/q-1/t9-,10-/m1/s1.
What are the key properties of tert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane?
tert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane has a molecular weight of 214.40 g/mol, XLogP of 3.54, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(3R,5R)-5-methylpyrrolidin-1-id-3-yl]oxysilane is sourced from PubChem (CID 91868284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).