O-(1-methoxybutyl)hydroxylamine

C5H13NO2 — CID 143289201

IUPACO-(1-methoxybutyl)hydroxylamine
SMILESCCCC(OC)ON
InChIInChI=1S/C5H13NO2/c1-3-4-5(7-2)8-6/h5H,3-4,6H2,1-2H3
InChIKeySLRAYRONLSVDEC-UHFFFAOYSA-N
MW119.16 g/mol
LogP0.65
Rot. Bonds4

About O-(1-methoxybutyl)hydroxylamine

O-(1-methoxybutyl)hydroxylamine (PubChem CID 143289201) has the molecular formula C5H13NO2 and a molecular weight of 119.16 g/mol. Its IUPAC name is O-(1-methoxybutyl)hydroxylamine.

Molecular Properties

Compound NameO-(1-methoxybutyl)hydroxylamine
PubChem CID143289201
Molecular FormulaC5H13NO2
Molecular Weight119.16 g/mol
Exact Mass119.09
IUPAC NameO-(1-methoxybutyl)hydroxylamine
SMILESCCCC(OC)ON
InChIInChI=1S/C5H13NO2/c1-3-4-5(7-2)8-6/h5H,3-4,6H2,1-2H3
InChIKeySLRAYRONLSVDEC-UHFFFAOYSA-N
XLogP0.65
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.16
LogP ≤ 50.65
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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Related Compounds

1-methoxybutyl 3-sulfanylpropanoate
CID 21275999
1-methoxybutoxy-bis(2-methylpropyl)alumane
CID 139905152
1-methoxybutyl 2-hydroxy-3-methoxyhexanoate
CID 139900400
1,1-dimethoxypentan-2-ylhydrazine
CID 105245906
1,1-dimethoxytetradecane
CID 13265409
1-methoxy-1-propoxypropane
CID 19963975
N-(2,2-dimethoxyethyl)pentan-2-amine
CID 60816170
dihexyl(1-methoxybutoxy)alumane
CID 139905179
ethyl (3R)-3-ethoxy-3-methoxypropanoate
CID 129409053
2-(1-methoxypropoxy)ethanamine
CID 147503736
1-(1-methoxyethoxy)butan-1-amine
CID 19838576
2-amino-N-(2,2-dimethoxyethyl)pentanamide
CID 61274915

Frequently Asked Questions

What is the IUPAC name of O-(1-methoxybutyl)hydroxylamine?
The IUPAC name of O-(1-methoxybutyl)hydroxylamine (CID 143289201) is O-(1-methoxybutyl)hydroxylamine.
What is the SMILES notation for O-(1-methoxybutyl)hydroxylamine?
The canonical SMILES for O-(1-methoxybutyl)hydroxylamine is CCCC(OC)ON.
What is the InChIKey of O-(1-methoxybutyl)hydroxylamine?
The InChIKey is SLRAYRONLSVDEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO2/c1-3-4-5(7-2)8-6/h5H,3-4,6H2,1-2H3.
What are the key properties of O-(1-methoxybutyl)hydroxylamine?
O-(1-methoxybutyl)hydroxylamine has a molecular weight of 119.16 g/mol, XLogP of 0.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-(1-methoxybutyl)hydroxylamine is sourced from PubChem (CID 143289201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).