O-(octylamino)hydroxylamine

C8H20N2O — CID 118072495

IUPACO-(octylamino)hydroxylamine
SMILESCCCCCCCCNON
InChIInChI=1S/C8H20N2O/c1-2-3-4-5-6-7-8-10-11-9/h10H,2-9H2,1H3
InChIKeyKRLXMAJUEBZYOT-UHFFFAOYSA-N
MW160.26 g/mol
LogP1.74
Rot. Bonds8

About O-(octylamino)hydroxylamine

O-(octylamino)hydroxylamine (PubChem CID 118072495) has the molecular formula C8H20N2O and a molecular weight of 160.26 g/mol. Its IUPAC name is O-(octylamino)hydroxylamine.

Molecular Properties

Compound NameO-(octylamino)hydroxylamine
PubChem CID118072495
Molecular FormulaC8H20N2O
Molecular Weight160.26 g/mol
Exact Mass160.16
IUPAC NameO-(octylamino)hydroxylamine
SMILESCCCCCCCCNON
InChIInChI=1S/C8H20N2O/c1-2-3-4-5-6-7-8-10-11-9/h10H,2-9H2,1H3
InChIKeyKRLXMAJUEBZYOT-UHFFFAOYSA-N
XLogP1.74
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 51.74
H-Bond Donors ≤ 52
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'}

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Frequently Asked Questions

What is the IUPAC name of O-(octylamino)hydroxylamine?
The IUPAC name of O-(octylamino)hydroxylamine (CID 118072495) is O-(octylamino)hydroxylamine.
What is the SMILES notation for O-(octylamino)hydroxylamine?
The canonical SMILES for O-(octylamino)hydroxylamine is CCCCCCCCNON.
What is the InChIKey of O-(octylamino)hydroxylamine?
The InChIKey is KRLXMAJUEBZYOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O/c1-2-3-4-5-6-7-8-10-11-9/h10H,2-9H2,1H3.
What are the key properties of O-(octylamino)hydroxylamine?
O-(octylamino)hydroxylamine has a molecular weight of 160.26 g/mol, XLogP of 1.74, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-(octylamino)hydroxylamine is sourced from PubChem (CID 118072495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).