6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine

C8H20N2O2Si — CID 90699584

IUPAC6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine
SMILESNCCC=CCC[Si](O)(O)CCN
InChIInChI=1S/C8H20N2O2Si/c9-5-3-1-2-4-7-13(11,12)8-6-10/h1-2,11-12H,3-10H2
InChIKeyUGXKJYXHDULIGY-UHFFFAOYSA-N
MW204.35 g/mol
LogP-0.33
Rot. Bonds7

About 6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine

6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine (PubChem CID 90699584) has the molecular formula C8H20N2O2Si and a molecular weight of 204.35 g/mol. Its IUPAC name is 6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine.

Molecular Properties

Compound Name6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine
PubChem CID90699584
Molecular FormulaC8H20N2O2Si
Molecular Weight204.35 g/mol
Exact Mass204.13
IUPAC Name6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine
SMILESNCCC=CCC[Si](O)(O)CCN
InChIInChI=1S/C8H20N2O2Si/c9-5-3-1-2-4-7-13(11,12)8-6-10/h1-2,11-12H,3-10H2
InChIKeyUGXKJYXHDULIGY-UHFFFAOYSA-N
XLogP-0.33
TPSA92.50 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.35
LogP ≤ 5-0.33
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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 6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine?
The IUPAC name of 6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine (CID 90699584) is 6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine.
What is the SMILES notation for 6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine?
The canonical SMILES for 6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine is NCCC=CCC[Si](O)(O)CCN.
What is the InChIKey of 6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine?
The InChIKey is UGXKJYXHDULIGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O2Si/c9-5-3-1-2-4-7-13(11,12)8-6-10/h1-2,11-12H,3-10H2.
What are the key properties of 6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine?
6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine has a molecular weight of 204.35 g/mol, XLogP of -0.33, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-aminoethyl(dihydroxy)silyl]hex-3-en-1-amine is sourced from PubChem (CID 90699584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).