O-propoxyhydroxylamine

C3H9NO2 — CID 154113102

IUPACO-propoxyhydroxylamine
SMILESCCCOON
InChIInChI=1S/C3H9NO2/c1-2-3-5-6-4/h2-4H2,1H3
InChIKeyWPKWIQXYPFUNSY-UHFFFAOYSA-N
MW91.11 g/mol
LogP0.22
Rot. Bonds3

About O-propoxyhydroxylamine

O-propoxyhydroxylamine (PubChem CID 154113102) has the molecular formula C3H9NO2 and a molecular weight of 91.11 g/mol. Its IUPAC name is O-propoxyhydroxylamine.

Molecular Properties

Compound NameO-propoxyhydroxylamine
PubChem CID154113102
Molecular FormulaC3H9NO2
Molecular Weight91.11 g/mol
Exact Mass91.06
IUPAC NameO-propoxyhydroxylamine
SMILESCCCOON
InChIInChI=1S/C3H9NO2/c1-2-3-5-6-4/h2-4H2,1H3
InChIKeyWPKWIQXYPFUNSY-UHFFFAOYSA-N
XLogP0.22
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50091.11
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(iodomethylperoxy)propane
CID 122501010
2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;O-propylhydroxylamine
CID 87989869
1-(1,2,2-tripropoxyethenoxy)propane
CID 12561622
1-[2-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propane
CID 88861501
dichloro(propoxy)phosphane
CID 536189
1-(1,1-dipropoxyethoxy)propane
CID 21433420
4-propylperoxybutyl acetate
CID 151563816
3-(propylperoxymethoxy)propan-1-amine
CID 170060757
propyl 2-hydroxypropaneperoxoate
CID 91194019
propyl ethaneperoxoate
CID 160583975
1-propoxyperoxyundecane
CID 90109462
1-propylperoxyperoxydodecane
CID 90108856

Frequently Asked Questions

What is the IUPAC name of O-propoxyhydroxylamine?
The IUPAC name of O-propoxyhydroxylamine (CID 154113102) is O-propoxyhydroxylamine.
What is the SMILES notation for O-propoxyhydroxylamine?
The canonical SMILES for O-propoxyhydroxylamine is CCCOON.
What is the InChIKey of O-propoxyhydroxylamine?
The InChIKey is WPKWIQXYPFUNSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NO2/c1-2-3-5-6-4/h2-4H2,1H3.
What are the key properties of O-propoxyhydroxylamine?
O-propoxyhydroxylamine has a molecular weight of 91.11 g/mol, XLogP of 0.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-propoxyhydroxylamine is sourced from PubChem (CID 154113102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).