O-butylhydroxylamine;hydroxylamine

C4H14N2O2 — CID 19968689

IUPACO-butylhydroxylamine;hydroxylamine
SMILESCCCCON.NO
InChIInChI=1S/C4H11NO.H3NO/c1-2-3-4-6-5;1-2/h2-5H2,1H3;2H,1H2
InChIKeyMQKYNBAWSCKKMT-UHFFFAOYSA-N
MW122.17 g/mol
LogP0.01
Rot. Bonds3

About O-butylhydroxylamine;hydroxylamine

O-butylhydroxylamine;hydroxylamine (PubChem CID 19968689) has the molecular formula C4H14N2O2 and a molecular weight of 122.17 g/mol. Its IUPAC name is O-butylhydroxylamine;hydroxylamine.

Molecular Properties

Compound NameO-butylhydroxylamine;hydroxylamine
PubChem CID19968689
Molecular FormulaC4H14N2O2
Molecular Weight122.17 g/mol
Exact Mass122.11
IUPAC NameO-butylhydroxylamine;hydroxylamine
SMILESCCCCON.NO
InChIInChI=1S/C4H11NO.H3NO/c1-2-3-4-6-5;1-2/h2-5H2,1H3;2H,1H2
InChIKeyMQKYNBAWSCKKMT-UHFFFAOYSA-N
XLogP0.01
TPSA81.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 50.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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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Related Compounds

azane;O-butylhydroxylamine;dihydrochloride
CID 19968679
O-nonadecylhydroxylamine
CID 59050271
O-nonylhydroxylamine
CID 5118359
O-octacosylhydroxylamine
CID 151286755
O-hexylhydroxylamine;hydrobromide
CID 174943876
O-decylhydroxylamine;hydrazine
CID 158088007
O-ethylhydroxylamine;pentane
CID 91358328
O-(12-aminooxydodecyl)hydroxylamine
CID 134994458
1-butylperoxybutane;hydrogen peroxide
CID 162033267
O-pentylhydroxylamine;1,1,2-trimethylcyclopropane;hydrochloride
CID 175022077
N-(3-aminooxypropyl)hexadecanamide
CID 88573336
1-butylperoxybutane
CID 159275797

Frequently Asked Questions

What is the IUPAC name of O-butylhydroxylamine;hydroxylamine?
The IUPAC name of O-butylhydroxylamine;hydroxylamine (CID 19968689) is O-butylhydroxylamine;hydroxylamine.
What is the SMILES notation for O-butylhydroxylamine;hydroxylamine?
The canonical SMILES for O-butylhydroxylamine;hydroxylamine is CCCCON.NO.
What is the InChIKey of O-butylhydroxylamine;hydroxylamine?
The InChIKey is MQKYNBAWSCKKMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NO.H3NO/c1-2-3-4-6-5;1-2/h2-5H2,1H3;2H,1H2.
What are the key properties of O-butylhydroxylamine;hydroxylamine?
O-butylhydroxylamine;hydroxylamine has a molecular weight of 122.17 g/mol, XLogP of 0.01, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for O-butylhydroxylamine;hydroxylamine is sourced from PubChem (CID 19968689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).