[diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane

C23H33NOSi — CID 25177950

IUPAC[diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane
SMILESCC[Si](CC)(CC)OC(c1ccccc1)(c1ccccc1)[C@H]1CCCN1
InChIInChI=1S/C23H33NOSi/c1-4-26(5-2,6-3)25-23(22-18-13-19-24-22,20-14-9-7-10-15-20)21-16-11-8-12-17-21/h7-12,14-17,22,24H,4-6,13,18-19H2,1-3H3/t22-/m1/s1
InChIKeyIBZUYVBRWOKYBZ-JOCHJYFZSA-N
MW367.61 g/mol
LogP5.70
Rot. Bonds8

About [diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane

[diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane (PubChem CID 25177950) has the molecular formula C23H33NOSi and a molecular weight of 367.61 g/mol. Its IUPAC name is [diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane.

Molecular Properties

Compound Name[diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane
PubChem CID25177950
Molecular FormulaC23H33NOSi
Molecular Weight367.61 g/mol
Exact Mass367.23
IUPAC Name[diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane
SMILESCC[Si](CC)(CC)OC(c1ccccc1)(c1ccccc1)[C@H]1CCCN1
InChIInChI=1S/C23H33NOSi/c1-4-26(5-2,6-3)25-23(22-18-13-19-24-22,20-14-9-7-10-15-20)21-16-11-8-12-17-21/h7-12,14-17,22,24H,4-6,13,18-19H2,1-3H3/t22-/m1/s1
InChIKeyIBZUYVBRWOKYBZ-JOCHJYFZSA-N
XLogP5.70
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.61
LogP ≤ 55.70
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 [diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane?
The IUPAC name of [diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane (CID 25177950) is [diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane.
What is the SMILES notation for [diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane?
The canonical SMILES for [diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane is CC[Si](CC)(CC)OC(c1ccccc1)(c1ccccc1)[C@H]1CCCN1.
What is the InChIKey of [diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane?
The InChIKey is IBZUYVBRWOKYBZ-JOCHJYFZSA-N. The full InChI is InChI=1S/C23H33NOSi/c1-4-26(5-2,6-3)25-23(22-18-13-19-24-22,20-14-9-7-10-15-20)21-16-11-8-12-17-21/h7-12,14-17,22,24H,4-6,13,18-19H2,1-3H3/t22-/m1/s1.
What are the key properties of [diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane?
[diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane has a molecular weight of 367.61 g/mol, XLogP of 5.70, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [diphenyl-[(2R)-pyrrolidin-2-yl]methoxy]-triethylsilane is sourced from PubChem (CID 25177950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).