lithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane

C16H26LiNOSi — CID 10107896

IUPAClithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane
SMILESCOC[C@@H]1CCCN1C[Si](C)(C)[CH-]c1ccccc1.[Li+]
InChIInChI=1S/C16H26NOSi.Li/c1-18-12-16-10-7-11-17(16)14-19(2,3)13-15-8-5-4-6-9-15;/h4-6,8-9,13,16H,7,10-12,14H2,1-3H3;/q-1;+1/t16-;/m0./s1
InChIKeyRPXPZKLHMXXWTG-NTISSMGPSA-N
MW283.42 g/mol
LogP0.14
Rot. Bonds6

About lithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane

lithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane (PubChem CID 10107896) has the molecular formula C16H26LiNOSi and a molecular weight of 283.42 g/mol. Its IUPAC name is lithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane.

Molecular Properties

Compound Namelithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane
PubChem CID10107896
Molecular FormulaC16H26LiNOSi
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Namelithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane
SMILESCOC[C@@H]1CCCN1C[Si](C)(C)[CH-]c1ccccc1.[Li+]
InChIInChI=1S/C16H26NOSi.Li/c1-18-12-16-10-7-11-17(16)14-19(2,3)13-15-8-5-4-6-9-15;/h4-6,8-9,13,16H,7,10-12,14H2,1-3H3;/q-1;+1/t16-;/m0./s1
InChIKeyRPXPZKLHMXXWTG-NTISSMGPSA-N
XLogP0.14
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 50.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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CID 201371
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CID 155139254
(2R)-1-[3-(4-fluorophenyl)-3-methylbutyl]-2-(methoxymethyl)pyrrolidine
CID 155139259
1-[3-(4-Fluorophenyl)-3-methylbutyl]-2-(methoxymethyl)pyrrolidine
CID 166925370
[2-(Methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(1-phenylethyl)silane
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1-[(2S)-2-[[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethylsilyl]-2-phenylethyl]cyclohexan-1-ol
CID 10023254
benzyl-[[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl]-dimethylsilane
CID 10107897
(2S)-1-[[2-[(2E)-3,7-dimethylocta-2,6-dienyl]selanylphenyl]methyl]-2-(methoxymethyl)pyrrolidine
CID 11811857
Lithium [2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane
CID 12048666
1-[(Benzyldimethylsilyl)methyl)-2-(methoxymethyl) pyrrolidine
CID 12048667
tert-butyl-dimethyl-[[(2S)-1-[(E)-3-phenylprop-2-enyl]pyrrolidin-2-yl]methoxy]silane
CID 12069185
(2S)-2-(methoxymethyl)-1-[(E)-3-phenylprop-2-enyl]pyrrolidine
CID 12598576

Frequently Asked Questions

What is the IUPAC name of lithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane?
The IUPAC name of lithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane (CID 10107896) is lithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane.
What is the SMILES notation for lithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane?
The canonical SMILES for lithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane is COC[C@@H]1CCCN1C[Si](C)(C)[CH-]c1ccccc1.[Li+].
What is the InChIKey of lithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane?
The InChIKey is RPXPZKLHMXXWTG-NTISSMGPSA-N. The full InChI is InChI=1S/C16H26NOSi.Li/c1-18-12-16-10-7-11-17(16)14-19(2,3)13-15-8-5-4-6-9-15;/h4-6,8-9,13,16H,7,10-12,14H2,1-3H3;/q-1;+1/t16-;/m0./s1.
What are the key properties of lithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane?
lithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane has a molecular weight of 283.42 g/mol, XLogP of 0.14, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-(phenylmethyl)silane is sourced from PubChem (CID 10107896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).