O-hexylhydroxylamine

C6H15NO — CID 14173363

IUPACO-hexylhydroxylamine
SMILESCCCCCCON
InChIInChI=1S/C6H15NO/c1-2-3-4-5-6-8-7/h2-7H2,1H3
InChIKeyAIPBDRLFQKUETL-UHFFFAOYSA-N
MW117.19 g/mol
LogP1.46
Rot. Bonds5

About O-hexylhydroxylamine

O-hexylhydroxylamine (PubChem CID 14173363) has the molecular formula C6H15NO and a molecular weight of 117.19 g/mol. Its IUPAC name is O-hexylhydroxylamine.

Molecular Properties

Compound NameO-hexylhydroxylamine
PubChem CID14173363
Molecular FormulaC6H15NO
Molecular Weight117.19 g/mol
Exact Mass117.12
IUPAC NameO-hexylhydroxylamine
SMILESCCCCCCON
InChIInChI=1S/C6H15NO/c1-2-3-4-5-6-8-7/h2-7H2,1H3
InChIKeyAIPBDRLFQKUETL-UHFFFAOYSA-N
XLogP1.46
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.19
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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-hexylhydroxylamine?
The IUPAC name of O-hexylhydroxylamine (CID 14173363) is O-hexylhydroxylamine.
What is the SMILES notation for O-hexylhydroxylamine?
The canonical SMILES for O-hexylhydroxylamine is CCCCCCON.
What is the InChIKey of O-hexylhydroxylamine?
The InChIKey is AIPBDRLFQKUETL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO/c1-2-3-4-5-6-8-7/h2-7H2,1H3.
What are the key properties of O-hexylhydroxylamine?
O-hexylhydroxylamine has a molecular weight of 117.19 g/mol, XLogP of 1.46, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-hexylhydroxylamine is sourced from PubChem (CID 14173363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).