N-[bis(hydroxyamino)-propylsilyl]hydroxylamine

C3H13N3O3Si — CID 54215596

IUPACN-[bis(hydroxyamino)-propylsilyl]hydroxylamine
SMILESCCC[Si](NO)(NO)NO
InChIInChI=1S/C3H13N3O3Si/c1-2-3-10(4-7,5-8)6-9/h4-9H,2-3H2,1H3
InChIKeyPYYVTRKXLYHIMM-UHFFFAOYSA-N
MW167.24 g/mol
LogP-0.73
Rot. Bonds5

About N-[bis(hydroxyamino)-propylsilyl]hydroxylamine

N-[bis(hydroxyamino)-propylsilyl]hydroxylamine (PubChem CID 54215596) has the molecular formula C3H13N3O3Si and a molecular weight of 167.24 g/mol. Its IUPAC name is N-[bis(hydroxyamino)-propylsilyl]hydroxylamine.

Molecular Properties

Compound NameN-[bis(hydroxyamino)-propylsilyl]hydroxylamine
PubChem CID54215596
Molecular FormulaC3H13N3O3Si
Molecular Weight167.24 g/mol
Exact Mass167.07
IUPAC NameN-[bis(hydroxyamino)-propylsilyl]hydroxylamine
SMILESCCC[Si](NO)(NO)NO
InChIInChI=1S/C3H13N3O3Si/c1-2-3-10(4-7,5-8)6-9/h4-9H,2-3H2,1H3
InChIKeyPYYVTRKXLYHIMM-UHFFFAOYSA-N
XLogP-0.73
TPSA96.78 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500167.24
LogP ≤ 5-0.73
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[bis(hydroxyamino)-propylsilyl]hydroxylamine?
The IUPAC name of N-[bis(hydroxyamino)-propylsilyl]hydroxylamine (CID 54215596) is N-[bis(hydroxyamino)-propylsilyl]hydroxylamine.
What is the SMILES notation for N-[bis(hydroxyamino)-propylsilyl]hydroxylamine?
The canonical SMILES for N-[bis(hydroxyamino)-propylsilyl]hydroxylamine is CCC[Si](NO)(NO)NO.
What is the InChIKey of N-[bis(hydroxyamino)-propylsilyl]hydroxylamine?
The InChIKey is PYYVTRKXLYHIMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H13N3O3Si/c1-2-3-10(4-7,5-8)6-9/h4-9H,2-3H2,1H3.
What are the key properties of N-[bis(hydroxyamino)-propylsilyl]hydroxylamine?
N-[bis(hydroxyamino)-propylsilyl]hydroxylamine has a molecular weight of 167.24 g/mol, XLogP of -0.73, 5 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[bis(hydroxyamino)-propylsilyl]hydroxylamine is sourced from PubChem (CID 54215596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).