[(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane

C15H31NOSi — CID 10659619

IUPAC[(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane
SMILESCC/C(=C/[C@H](C)[Si](C)(C)C)N1CCC[C@H]1COC
InChIInChI=1S/C15H31NOSi/c1-7-14(11-13(2)18(4,5)6)16-10-8-9-15(16)12-17-3/h11,13,15H,7-10,12H2,1-6H3/b14-11-/t13-,15-/m0/s1
InChIKeyUYRSDHRDEUEUEL-LANAQNJFSA-N
MW269.50 g/mol
LogP4.12
Rot. Bonds6

About [(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane

[(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane (PubChem CID 10659619) has the molecular formula C15H31NOSi and a molecular weight of 269.50 g/mol. Its IUPAC name is [(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane.

Molecular Properties

Compound Name[(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane
PubChem CID10659619
Molecular FormulaC15H31NOSi
Molecular Weight269.50 g/mol
Exact Mass269.22
IUPAC Name[(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane
SMILESCC/C(=C/[C@H](C)[Si](C)(C)C)N1CCC[C@H]1COC
InChIInChI=1S/C15H31NOSi/c1-7-14(11-13(2)18(4,5)6)16-10-8-9-15(16)12-17-3/h11,13,15H,7-10,12H2,1-6H3/b14-11-/t13-,15-/m0/s1
InChIKeyUYRSDHRDEUEUEL-LANAQNJFSA-N
XLogP4.12
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.50
LogP ≤ 54.12
H-Bond Donors ≤ 50
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 [(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane?
The IUPAC name of [(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane (CID 10659619) is [(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane.
What is the SMILES notation for [(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane?
The canonical SMILES for [(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane is CC/C(=C/[C@H](C)[Si](C)(C)C)N1CCC[C@H]1COC.
What is the InChIKey of [(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane?
The InChIKey is UYRSDHRDEUEUEL-LANAQNJFSA-N. The full InChI is InChI=1S/C15H31NOSi/c1-7-14(11-13(2)18(4,5)6)16-10-8-9-15(16)12-17-3/h11,13,15H,7-10,12H2,1-6H3/b14-11-/t13-,15-/m0/s1.
What are the key properties of [(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane?
[(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane has a molecular weight of 269.50 g/mol, XLogP of 4.12, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z,2S)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]hex-3-en-2-yl]-trimethylsilane is sourced from PubChem (CID 10659619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).