3-[diethoxy(methyl)silyl]pent-3-en-1-amine

C10H23NO2Si — CID 91022141

IUPAC3-[diethoxy(methyl)silyl]pent-3-en-1-amine
SMILESCC=C(CCN)[Si](C)(OCC)OCC
InChIInChI=1S/C10H23NO2Si/c1-5-10(8-9-11)14(4,12-6-2)13-7-3/h5H,6-9,11H2,1-4H3
InChIKeyGJHZIEXFALJFEY-UHFFFAOYSA-N
MW217.38 g/mol
LogP1.97
Rot. Bonds7

About 3-[diethoxy(methyl)silyl]pent-3-en-1-amine

3-[diethoxy(methyl)silyl]pent-3-en-1-amine (PubChem CID 91022141) has the molecular formula C10H23NO2Si and a molecular weight of 217.38 g/mol. Its IUPAC name is 3-[diethoxy(methyl)silyl]pent-3-en-1-amine.

Molecular Properties

Compound Name3-[diethoxy(methyl)silyl]pent-3-en-1-amine
PubChem CID91022141
Molecular FormulaC10H23NO2Si
Molecular Weight217.38 g/mol
Exact Mass217.15
IUPAC Name3-[diethoxy(methyl)silyl]pent-3-en-1-amine
SMILESCC=C(CCN)[Si](C)(OCC)OCC
InChIInChI=1S/C10H23NO2Si/c1-5-10(8-9-11)14(4,12-6-2)13-7-3/h5H,6-9,11H2,1-4H3
InChIKeyGJHZIEXFALJFEY-UHFFFAOYSA-N
XLogP1.97
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.38
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 3-[diethoxy(methyl)silyl]pent-3-en-1-amine?
The IUPAC name of 3-[diethoxy(methyl)silyl]pent-3-en-1-amine (CID 91022141) is 3-[diethoxy(methyl)silyl]pent-3-en-1-amine.
What is the SMILES notation for 3-[diethoxy(methyl)silyl]pent-3-en-1-amine?
The canonical SMILES for 3-[diethoxy(methyl)silyl]pent-3-en-1-amine is CC=C(CCN)[Si](C)(OCC)OCC.
What is the InChIKey of 3-[diethoxy(methyl)silyl]pent-3-en-1-amine?
The InChIKey is GJHZIEXFALJFEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2Si/c1-5-10(8-9-11)14(4,12-6-2)13-7-3/h5H,6-9,11H2,1-4H3.
What are the key properties of 3-[diethoxy(methyl)silyl]pent-3-en-1-amine?
3-[diethoxy(methyl)silyl]pent-3-en-1-amine has a molecular weight of 217.38 g/mol, XLogP of 1.97, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[diethoxy(methyl)silyl]pent-3-en-1-amine is sourced from PubChem (CID 91022141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).