N-[diethoxy(methyl)silyl]prop-2-en-1-amine

C8H19NO2Si — CID 88710939

IUPACN-[diethoxy(methyl)silyl]prop-2-en-1-amine
SMILESC=CCN[Si](C)(OCC)OCC
InChIInChI=1S/C8H19NO2Si/c1-5-8-9-12(4,10-6-2)11-7-3/h5,9H,1,6-8H2,2-4H3
InChIKeyGBCKTGQHPYRNNM-UHFFFAOYSA-N
MW189.33 g/mol
LogP1.40
Rot. Bonds7

About N-[diethoxy(methyl)silyl]prop-2-en-1-amine

N-[diethoxy(methyl)silyl]prop-2-en-1-amine (PubChem CID 88710939) has the molecular formula C8H19NO2Si and a molecular weight of 189.33 g/mol. Its IUPAC name is N-[diethoxy(methyl)silyl]prop-2-en-1-amine.

Molecular Properties

Compound NameN-[diethoxy(methyl)silyl]prop-2-en-1-amine
PubChem CID88710939
Molecular FormulaC8H19NO2Si
Molecular Weight189.33 g/mol
Exact Mass189.12
IUPAC NameN-[diethoxy(methyl)silyl]prop-2-en-1-amine
SMILESC=CCN[Si](C)(OCC)OCC
InChIInChI=1S/C8H19NO2Si/c1-5-8-9-12(4,10-6-2)11-7-3/h5,9H,1,6-8H2,2-4H3
InChIKeyGBCKTGQHPYRNNM-UHFFFAOYSA-N
XLogP1.40
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.33
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[diethoxy(methyl)silyl]prop-2-en-1-amine?
The IUPAC name of N-[diethoxy(methyl)silyl]prop-2-en-1-amine (CID 88710939) is N-[diethoxy(methyl)silyl]prop-2-en-1-amine.
What is the SMILES notation for N-[diethoxy(methyl)silyl]prop-2-en-1-amine?
The canonical SMILES for N-[diethoxy(methyl)silyl]prop-2-en-1-amine is C=CCN[Si](C)(OCC)OCC.
What is the InChIKey of N-[diethoxy(methyl)silyl]prop-2-en-1-amine?
The InChIKey is GBCKTGQHPYRNNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO2Si/c1-5-8-9-12(4,10-6-2)11-7-3/h5,9H,1,6-8H2,2-4H3.
What are the key properties of N-[diethoxy(methyl)silyl]prop-2-en-1-amine?
N-[diethoxy(methyl)silyl]prop-2-en-1-amine has a molecular weight of 189.33 g/mol, XLogP of 1.40, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[diethoxy(methyl)silyl]prop-2-en-1-amine is sourced from PubChem (CID 88710939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).