O-(2-nitrosopropyl)hydroxylamine

C3H8N2O2 — CID 121258212

IUPACO-(2-nitrosopropyl)hydroxylamine
SMILESCC(CON)N=O
InChIInChI=1S/C3H8N2O2/c1-3(5-6)2-7-4/h3H,2,4H2,1H3
InChIKeyMQPMJJICUGRDFM-UHFFFAOYSA-N
MW104.11 g/mol
LogP0.03
Rot. Bonds3

About O-(2-nitrosopropyl)hydroxylamine

O-(2-nitrosopropyl)hydroxylamine (PubChem CID 121258212) has the molecular formula C3H8N2O2 and a molecular weight of 104.11 g/mol. Its IUPAC name is O-(2-nitrosopropyl)hydroxylamine.

Molecular Properties

Compound NameO-(2-nitrosopropyl)hydroxylamine
PubChem CID121258212
Molecular FormulaC3H8N2O2
Molecular Weight104.11 g/mol
Exact Mass104.06
IUPAC NameO-(2-nitrosopropyl)hydroxylamine
SMILESCC(CON)N=O
InChIInChI=1S/C3H8N2O2/c1-3(5-6)2-7-4/h3H,2,4H2,1H3
InChIKeyMQPMJJICUGRDFM-UHFFFAOYSA-N
XLogP0.03
TPSA64.68 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.11
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2,5-dinitrosohexane
CID 54503397
O-(2,4-dimethylpentyl)hydroxylamine
CID 130481155
2-(aminooxymethyl)-3-methylbutanoic acid
CID 105429040
N-methyl-3-nitrosobutan-1-amine
CID 88885993
2-nitroso-N-propan-2-ylpropan-1-amine
CID 22213580
triethyl(2-nitrosopropyl)azanium
CID 91505361
O-[2-(methylidene-λ3-iodanyl)-2-(propan-2-ylamino)ethyl]hydroxylamine
CID 163939305
2-methylpropanehydrazide;O-(2-methylpropyl)hydroxylamine
CID 164972287
bis(2-chloro-3-methylbutyl) carbonate
CID 162517104
CID 89217446
CID 89217446
N'-(1-methoxypropan-2-yl)ethanimidamide
CID 62049796
2-methylpropyl 2-[[2-(2-methylpropoxy)-2-oxoethyl]diazenyl]acetate
CID 54481908

Frequently Asked Questions

What is the IUPAC name of O-(2-nitrosopropyl)hydroxylamine?
The IUPAC name of O-(2-nitrosopropyl)hydroxylamine (CID 121258212) is O-(2-nitrosopropyl)hydroxylamine.
What is the SMILES notation for O-(2-nitrosopropyl)hydroxylamine?
The canonical SMILES for O-(2-nitrosopropyl)hydroxylamine is CC(CON)N=O.
What is the InChIKey of O-(2-nitrosopropyl)hydroxylamine?
The InChIKey is MQPMJJICUGRDFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N2O2/c1-3(5-6)2-7-4/h3H,2,4H2,1H3.
What are the key properties of O-(2-nitrosopropyl)hydroxylamine?
O-(2-nitrosopropyl)hydroxylamine has a molecular weight of 104.11 g/mol, XLogP of 0.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for O-(2-nitrosopropyl)hydroxylamine is sourced from PubChem (CID 121258212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).