O-(2-methylpropyl)hydroxylamine

C4H11NO — CID 536422

IUPACO-(2-methylpropyl)hydroxylamine
SMILESCC(C)CON
InChIInChI=1S/C4H11NO/c1-4(2)3-6-5/h4H,3,5H2,1-2H3
InChIKeyRUMFZCKCISCDMG-UHFFFAOYSA-N
MW89.14 g/mol
LogP0.53
Rot. Bonds2

About O-(2-methylpropyl)hydroxylamine

O-(2-methylpropyl)hydroxylamine (PubChem CID 536422) has the molecular formula C4H11NO and a molecular weight of 89.14 g/mol. Its IUPAC name is O-(2-methylpropyl)hydroxylamine.

Molecular Properties

Compound NameO-(2-methylpropyl)hydroxylamine
PubChem CID536422
Molecular FormulaC4H11NO
Molecular Weight89.14 g/mol
Exact Mass89.08
IUPAC NameO-(2-methylpropyl)hydroxylamine
SMILESCC(C)CON
InChIInChI=1S/C4H11NO/c1-4(2)3-6-5/h4H,3,5H2,1-2H3
InChIKeyRUMFZCKCISCDMG-UHFFFAOYSA-N
XLogP0.53
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50089.14
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 O-(2-methylpropyl)hydroxylamine?
The IUPAC name of O-(2-methylpropyl)hydroxylamine (CID 536422) is O-(2-methylpropyl)hydroxylamine.
What is the SMILES notation for O-(2-methylpropyl)hydroxylamine?
The canonical SMILES for O-(2-methylpropyl)hydroxylamine is CC(C)CON.
What is the InChIKey of O-(2-methylpropyl)hydroxylamine?
The InChIKey is RUMFZCKCISCDMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NO/c1-4(2)3-6-5/h4H,3,5H2,1-2H3.
What are the key properties of O-(2-methylpropyl)hydroxylamine?
O-(2-methylpropyl)hydroxylamine has a molecular weight of 89.14 g/mol, XLogP of 0.53, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-(2-methylpropyl)hydroxylamine is sourced from PubChem (CID 536422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).