N-(diethylamino)hydroxylamine

C4H12N2O — CID 18317170

IUPACN-(diethylamino)hydroxylamine
SMILESCCN(CC)NO
InChIInChI=1S/C4H12N2O/c1-3-6(4-2)5-7/h5,7H,3-4H2,1-2H3
InChIKeyPJOXQDHMAKBJFN-UHFFFAOYSA-N
MW104.15 g/mol
LogP0.22
Rot. Bonds3

About N-(diethylamino)hydroxylamine

N-(diethylamino)hydroxylamine (PubChem CID 18317170) has the molecular formula C4H12N2O and a molecular weight of 104.15 g/mol. Its IUPAC name is N-(diethylamino)hydroxylamine.

Molecular Properties

Compound NameN-(diethylamino)hydroxylamine
PubChem CID18317170
Molecular FormulaC4H12N2O
Molecular Weight104.15 g/mol
Exact Mass104.09
IUPAC NameN-(diethylamino)hydroxylamine
SMILESCCN(CC)NO
InChIInChI=1S/C4H12N2O/c1-3-6(4-2)5-7/h5,7H,3-4H2,1-2H3
InChIKeyPJOXQDHMAKBJFN-UHFFFAOYSA-N
XLogP0.22
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.15
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(diethylamino)hydroxylamine?
The IUPAC name of N-(diethylamino)hydroxylamine (CID 18317170) is N-(diethylamino)hydroxylamine.
What is the SMILES notation for N-(diethylamino)hydroxylamine?
The canonical SMILES for N-(diethylamino)hydroxylamine is CCN(CC)NO.
What is the InChIKey of N-(diethylamino)hydroxylamine?
The InChIKey is PJOXQDHMAKBJFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N2O/c1-3-6(4-2)5-7/h5,7H,3-4H2,1-2H3.
What are the key properties of N-(diethylamino)hydroxylamine?
N-(diethylamino)hydroxylamine has a molecular weight of 104.15 g/mol, XLogP of 0.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(diethylamino)hydroxylamine is sourced from PubChem (CID 18317170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).