O-[1-(diethylamino)propyl]hydroxylamine

C7H18N2O — CID 20572600

IUPACO-[1-(diethylamino)propyl]hydroxylamine
SMILESCCC(ON)N(CC)CC
InChIInChI=1S/C7H18N2O/c1-4-7(10-8)9(5-2)6-3/h7H,4-6,8H2,1-3H3
InChIKeyMCIQOYYIUJRPLP-UHFFFAOYSA-N
MW146.23 g/mol
LogP0.95
Rot. Bonds5

About O-[1-(diethylamino)propyl]hydroxylamine

O-[1-(diethylamino)propyl]hydroxylamine (PubChem CID 20572600) has the molecular formula C7H18N2O and a molecular weight of 146.23 g/mol. Its IUPAC name is O-[1-(diethylamino)propyl]hydroxylamine.

Molecular Properties

Compound NameO-[1-(diethylamino)propyl]hydroxylamine
PubChem CID20572600
Molecular FormulaC7H18N2O
Molecular Weight146.23 g/mol
Exact Mass146.14
IUPAC NameO-[1-(diethylamino)propyl]hydroxylamine
SMILESCCC(ON)N(CC)CC
InChIInChI=1S/C7H18N2O/c1-4-7(10-8)9(5-2)6-3/h7H,4-6,8H2,1-3H3
InChIKeyMCIQOYYIUJRPLP-UHFFFAOYSA-N
XLogP0.95
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', '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-[1-(diethylamino)propyl]hydroxylamine?
The IUPAC name of O-[1-(diethylamino)propyl]hydroxylamine (CID 20572600) is O-[1-(diethylamino)propyl]hydroxylamine.
What is the SMILES notation for O-[1-(diethylamino)propyl]hydroxylamine?
The canonical SMILES for O-[1-(diethylamino)propyl]hydroxylamine is CCC(ON)N(CC)CC.
What is the InChIKey of O-[1-(diethylamino)propyl]hydroxylamine?
The InChIKey is MCIQOYYIUJRPLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O/c1-4-7(10-8)9(5-2)6-3/h7H,4-6,8H2,1-3H3.
What are the key properties of O-[1-(diethylamino)propyl]hydroxylamine?
O-[1-(diethylamino)propyl]hydroxylamine has a molecular weight of 146.23 g/mol, XLogP of 0.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[1-(diethylamino)propyl]hydroxylamine is sourced from PubChem (CID 20572600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).