2-propoxysilylethane-1,1,1-triamine

C5H17N3OSi — CID 175412053

IUPAC2-propoxysilylethane-1,1,1-triamine
SMILESCCCO[SiH2]CC(N)(N)N
InChIInChI=1S/C5H17N3OSi/c1-2-3-9-10-4-5(6,7)8/h2-4,6-8,10H2,1H3
InChIKeyYLEBUJBUZBTQBC-UHFFFAOYSA-N
MW163.30 g/mol
LogP-1.55
Rot. Bonds5

About 2-propoxysilylethane-1,1,1-triamine

2-propoxysilylethane-1,1,1-triamine (PubChem CID 175412053) has the molecular formula C5H17N3OSi and a molecular weight of 163.30 g/mol. Its IUPAC name is 2-propoxysilylethane-1,1,1-triamine.

Molecular Properties

Compound Name2-propoxysilylethane-1,1,1-triamine
PubChem CID175412053
Molecular FormulaC5H17N3OSi
Molecular Weight163.30 g/mol
Exact Mass163.11
IUPAC Name2-propoxysilylethane-1,1,1-triamine
SMILESCCCO[SiH2]CC(N)(N)N
InChIInChI=1S/C5H17N3OSi/c1-2-3-9-10-4-5(6,7)8/h2-4,6-8,10H2,1H3
InChIKeyYLEBUJBUZBTQBC-UHFFFAOYSA-N
XLogP-1.55
TPSA87.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.30
LogP ≤ 5-1.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

propoxy(trichloromethyl)silane
CID 154081692
butane;methyl(propoxy)silane
CID 123175569
diethyl(propoxy)silane;ethyl(propoxy)silane
CID 159167086
1-(1,2,2-tripropoxyethenoxy)propane
CID 12561622
1,2,2,2-tetrapropoxyethane-1,1-diamine
CID 140586071
2-chloroethoxy(4,4-dimethylpent-2-enyl)silane
CID 154114673
3-(oxiran-2-ylmethoxy)propyl-propoxysilane
CID 173042510
2-propoxyprop-2-en-1-amine
CID 129234391
butoxy(propoxy)silane;ethanol;molybdenum
CID 159427488
propyl 2-amino-2-methylpropanoate;hydrochloride
CID 134284248
hexane-3,3-diamine
CID 18331048
O-propoxyhydroxylamine
CID 154113102

Frequently Asked Questions

What is the IUPAC name of 2-propoxysilylethane-1,1,1-triamine?
The IUPAC name of 2-propoxysilylethane-1,1,1-triamine (CID 175412053) is 2-propoxysilylethane-1,1,1-triamine.
What is the SMILES notation for 2-propoxysilylethane-1,1,1-triamine?
The canonical SMILES for 2-propoxysilylethane-1,1,1-triamine is CCCO[SiH2]CC(N)(N)N.
What is the InChIKey of 2-propoxysilylethane-1,1,1-triamine?
The InChIKey is YLEBUJBUZBTQBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H17N3OSi/c1-2-3-9-10-4-5(6,7)8/h2-4,6-8,10H2,1H3.
What are the key properties of 2-propoxysilylethane-1,1,1-triamine?
2-propoxysilylethane-1,1,1-triamine has a molecular weight of 163.30 g/mol, XLogP of -1.55, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propoxysilylethane-1,1,1-triamine is sourced from PubChem (CID 175412053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).