O-prop-1-enylhydroxylamine;hydrochloride

C3H8ClNO — CID 141490090

IUPACO-prop-1-enylhydroxylamine;hydrochloride
SMILESCC=CON.Cl
InChIInChI=1S/C3H7NO.ClH/c1-2-3-5-4;/h2-3H,4H2,1H3;1H
InChIKeyQORZAWTTWXZZQU-UHFFFAOYSA-N
MW109.56 g/mol
LogP0.83
Rot. Bonds1

About O-prop-1-enylhydroxylamine;hydrochloride

O-prop-1-enylhydroxylamine;hydrochloride (PubChem CID 141490090) has the molecular formula C3H8ClNO and a molecular weight of 109.56 g/mol. Its IUPAC name is O-prop-1-enylhydroxylamine;hydrochloride.

Molecular Properties

Compound NameO-prop-1-enylhydroxylamine;hydrochloride
PubChem CID141490090
Molecular FormulaC3H8ClNO
Molecular Weight109.56 g/mol
Exact Mass109.03
IUPAC NameO-prop-1-enylhydroxylamine;hydrochloride
SMILESCC=CON.Cl
InChIInChI=1S/C3H7NO.ClH/c1-2-3-5-4;/h2-3H,4H2,1H3;1H
InChIKeyQORZAWTTWXZZQU-UHFFFAOYSA-N
XLogP0.83
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.56
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', '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 O-prop-1-enylhydroxylamine;hydrochloride?
The IUPAC name of O-prop-1-enylhydroxylamine;hydrochloride (CID 141490090) is O-prop-1-enylhydroxylamine;hydrochloride.
What is the SMILES notation for O-prop-1-enylhydroxylamine;hydrochloride?
The canonical SMILES for O-prop-1-enylhydroxylamine;hydrochloride is CC=CON.Cl.
What is the InChIKey of O-prop-1-enylhydroxylamine;hydrochloride?
The InChIKey is QORZAWTTWXZZQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO.ClH/c1-2-3-5-4;/h2-3H,4H2,1H3;1H.
What are the key properties of O-prop-1-enylhydroxylamine;hydrochloride?
O-prop-1-enylhydroxylamine;hydrochloride has a molecular weight of 109.56 g/mol, XLogP of 0.83, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-prop-1-enylhydroxylamine;hydrochloride is sourced from PubChem (CID 141490090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).