N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine

C14H30N2OSi — CID 23241582

IUPACN-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine
SMILESCC[Si](CC)(CC)CC=NN1CCC[C@H]1COC
InChIInChI=1S/C14H30N2OSi/c1-5-18(6-2,7-3)12-10-15-16-11-8-9-14(16)13-17-4/h10,14H,5-9,11-13H2,1-4H3/t14-/m0/s1
InChIKeyJTLOCORAZXMAQZ-AWEZNQCLSA-N
MW270.49 g/mol
LogP3.59
Rot. Bonds8

About N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine

N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine (PubChem CID 23241582) has the molecular formula C14H30N2OSi and a molecular weight of 270.49 g/mol. Its IUPAC name is N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine.

Molecular Properties

Compound NameN-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine
PubChem CID23241582
Molecular FormulaC14H30N2OSi
Molecular Weight270.49 g/mol
Exact Mass270.21
IUPAC NameN-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine
SMILESCC[Si](CC)(CC)CC=NN1CCC[C@H]1COC
InChIInChI=1S/C14H30N2OSi/c1-5-18(6-2,7-3)12-10-15-16-11-8-9-14(16)13-17-4/h10,14H,5-9,11-13H2,1-4H3/t14-/m0/s1
InChIKeyJTLOCORAZXMAQZ-AWEZNQCLSA-N
XLogP3.59
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.49
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(E)-N,N'-bis[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]pentane-1,5-diimine
CID 10892701
(E,6E,8E)-N-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]deca-6,8-dien-1-imine
CID 177391876
(E)-N-[2-(methoxymethyl)pyrrolidin-1-yl]butan-2-imine
CID 13198371
(1E)-1-[2-(methoxymethyl)pyrrolidin-1-yl]iminopent-4-en-2-ol
CID 177492712
(E)-2-methoxy-N-[(2S)-2-(2-methoxyethoxymethyl)pyrrolidin-1-yl]ethanimine
CID 11128124
N-[2-(methoxymethyl)pyrrolidin-1-yl]pentan-2-imine
CID 71323940
(E,E)-N-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-en-1-imine
CID 177407968
[(1E)-1-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]imino-3-methylbutan-2-yl] acetate
CID 10978077
(Z,2S)-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-methyl-3-phenylpropan-1-imine
CID 135050661
(2R)-1-ethyl-2-(methoxymethyl)pyrrolidine
CID 59678139
(E,2S)-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-phenylmethoxypropan-1-imine
CID 10956776
[(2R)-1-[(E)-propylideneamino]pyrrolidin-2-yl]methanol
CID 89018804

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine?
The IUPAC name of N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine (CID 23241582) is N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine.
What is the SMILES notation for N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine?
The canonical SMILES for N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine is CC[Si](CC)(CC)CC=NN1CCC[C@H]1COC.
What is the InChIKey of N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine?
The InChIKey is JTLOCORAZXMAQZ-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H30N2OSi/c1-5-18(6-2,7-3)12-10-15-16-11-8-9-14(16)13-17-4/h10,14H,5-9,11-13H2,1-4H3/t14-/m0/s1.
What are the key properties of N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine?
N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine has a molecular weight of 270.49 g/mol, XLogP of 3.59, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-triethylsilylethanimine is sourced from PubChem (CID 23241582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).