(1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol

C20H27NOSi — CID 152797697

IUPAC(1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol
SMILESCN1CCC[C@H]1[C@H](O)C[Si](C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H27NOSi/c1-21-15-9-14-19(21)20(22)16-23(2,17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-8,10-13,19-20,22H,9,14-16H2,1-2H3/t19-,20+/m0/s1
InChIKeySMOOCXTUUHRZHB-VQTJNVASSA-N
MW325.53 g/mol
LogP2.33
Rot. Bonds5

About (1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol

(1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol (PubChem CID 152797697) has the molecular formula C20H27NOSi and a molecular weight of 325.53 g/mol. Its IUPAC name is (1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol.

Molecular Properties

Compound Name(1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol
PubChem CID152797697
Molecular FormulaC20H27NOSi
Molecular Weight325.53 g/mol
Exact Mass325.19
IUPAC Name(1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol
SMILESCN1CCC[C@H]1[C@H](O)C[Si](C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H27NOSi/c1-21-15-9-14-19(21)20(22)16-23(2,17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-8,10-13,19-20,22H,9,14-16H2,1-2H3/t19-,20+/m0/s1
InChIKeySMOOCXTUUHRZHB-VQTJNVASSA-N
XLogP2.33
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.53
LogP ≤ 52.33
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 (1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol?
The IUPAC name of (1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol (CID 152797697) is (1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol.
What is the SMILES notation for (1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol?
The canonical SMILES for (1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol is CN1CCC[C@H]1[C@H](O)C[Si](C)(c1ccccc1)c1ccccc1.
What is the InChIKey of (1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol?
The InChIKey is SMOOCXTUUHRZHB-VQTJNVASSA-N. The full InChI is InChI=1S/C20H27NOSi/c1-21-15-9-14-19(21)20(22)16-23(2,17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-8,10-13,19-20,22H,9,14-16H2,1-2H3/t19-,20+/m0/s1.
What are the key properties of (1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol?
(1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol has a molecular weight of 325.53 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-2-[methyl(diphenyl)silyl]-1-[(2S)-1-methylpyrrolidin-2-yl]ethanol is sourced from PubChem (CID 152797697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).