2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine

C10H23N3O3Si — CID 174051682

IUPAC2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine
SMILESC=CCC(N)(C=C)C(N)(N)[Si](OC)(OC)OC
InChIInChI=1S/C10H23N3O3Si/c1-6-8-9(11,7-2)10(12,13)17(14-3,15-4)16-5/h6-7H,1-2,8,11-13H2,3-5H3
InChIKeyGBDLWSVDRQZYKM-UHFFFAOYSA-N
MW261.40 g/mol
LogP-0.52
Rot. Bonds8

About 2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine

2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine (PubChem CID 174051682) has the molecular formula C10H23N3O3Si and a molecular weight of 261.40 g/mol. Its IUPAC name is 2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine.

Molecular Properties

Compound Name2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine
PubChem CID174051682
Molecular FormulaC10H23N3O3Si
Molecular Weight261.40 g/mol
Exact Mass261.15
IUPAC Name2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine
SMILESC=CCC(N)(C=C)C(N)(N)[Si](OC)(OC)OC
InChIInChI=1S/C10H23N3O3Si/c1-6-8-9(11,7-2)10(12,13)17(14-3,15-4)16-5/h6-7H,1-2,8,11-13H2,3-5H3
InChIKeyGBDLWSVDRQZYKM-UHFFFAOYSA-N
XLogP-0.52
TPSA105.75 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.40
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine?
The IUPAC name of 2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine (CID 174051682) is 2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine.
What is the SMILES notation for 2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine?
The canonical SMILES for 2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine is C=CCC(N)(C=C)C(N)(N)[Si](OC)(OC)OC.
What is the InChIKey of 2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine?
The InChIKey is GBDLWSVDRQZYKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O3Si/c1-6-8-9(11,7-2)10(12,13)17(14-3,15-4)16-5/h6-7H,1-2,8,11-13H2,3-5H3.
What are the key properties of 2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine?
2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine has a molecular weight of 261.40 g/mol, XLogP of -0.52, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-1-trimethoxysilylpent-4-ene-1,1,2-triamine is sourced from PubChem (CID 174051682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).