2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol

C7H19NO5Si — CID 173272057

IUPAC2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol
SMILESNCCCOOO[SiH](CCO)CCO
InChIInChI=1S/C7H19NO5Si/c8-2-1-5-11-12-13-14(6-3-9)7-4-10/h9-10,14H,1-8H2
InChIKeyTZBMBGXEVVSSLL-UHFFFAOYSA-N
MW225.32 g/mol
LogP-1.08
Rot. Bonds10

About 2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol

2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol (PubChem CID 173272057) has the molecular formula C7H19NO5Si and a molecular weight of 225.32 g/mol. Its IUPAC name is 2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol.

Molecular Properties

Compound Name2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol
PubChem CID173272057
Molecular FormulaC7H19NO5Si
Molecular Weight225.32 g/mol
Exact Mass225.10
IUPAC Name2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol
SMILESNCCCOOO[SiH](CCO)CCO
InChIInChI=1S/C7H19NO5Si/c8-2-1-5-11-12-13-14(6-3-9)7-4-10/h9-10,14H,1-8H2
InChIKeyTZBMBGXEVVSSLL-UHFFFAOYSA-N
XLogP-1.08
TPSA94.17 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 5-1.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

4-[2-(3-aminopropoxy)ethoxy]butan-1-ol
CID 58517376
3-(silylmethoxyperoxy)propan-1-amine
CID 151871665
3-methoxyperoxypropan-1-ol
CID 90202053
2-[3-(3-aminopropoxy)propoxy]ethanol
CID 87504728
sodium;3-aminopropan-1-ol;hydride
CID 173357693
3-aminopropan-1-ol;ethane
CID 91172061
36-aminohexatriacontan-1-ol
CID 87686190
3-aminopropan-1-ol;ethenol
CID 87392158
2-aminoethanol;butane-1,4-diol
CID 135347340
2-[3-aminopropyl(2-hydroxyethoxy)silyl]oxyethanol
CID 173270044
3-hydroperoxypropan-1-amine
CID 90707028
3-[3-[2-(3-aminopropoxy)ethoxy]propoxy]propan-1-amine
CID 118897120

Frequently Asked Questions

What is the IUPAC name of 2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol?
The IUPAC name of 2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol (CID 173272057) is 2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol.
What is the SMILES notation for 2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol?
The canonical SMILES for 2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol is NCCCOOO[SiH](CCO)CCO.
What is the InChIKey of 2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol?
The InChIKey is TZBMBGXEVVSSLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19NO5Si/c8-2-1-5-11-12-13-14(6-3-9)7-4-10/h9-10,14H,1-8H2.
What are the key properties of 2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol?
2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol has a molecular weight of 225.32 g/mol, XLogP of -1.08, 10 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-aminopropoxyperoxy(2-hydroxyethyl)silyl]ethanol is sourced from PubChem (CID 173272057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).