2-hydroxyethyl(trimethyl)azanium;hydroxylamine

C5H17N2O2+ — CID 86628599

IUPAC2-hydroxyethyl(trimethyl)azanium;hydroxylamine
SMILESC[N+](C)(C)CCO.NO
InChIInChI=1S/C5H14NO.H3NO/c1-6(2,3)4-5-7;1-2/h7H,4-5H2,1-3H3;2H,1H2/q+1;
InChIKeyYZJXKDOIZCRGJY-UHFFFAOYSA-N
MW137.20 g/mol
LogP-0.98
Rot. Bonds2

About 2-hydroxyethyl(trimethyl)azanium;hydroxylamine

2-hydroxyethyl(trimethyl)azanium;hydroxylamine (PubChem CID 86628599) has the molecular formula C5H17N2O2+ and a molecular weight of 137.20 g/mol. Its IUPAC name is 2-hydroxyethyl(trimethyl)azanium;hydroxylamine.

Molecular Properties

Compound Name2-hydroxyethyl(trimethyl)azanium;hydroxylamine
PubChem CID86628599
Molecular FormulaC5H17N2O2+
Molecular Weight137.20 g/mol
Exact Mass137.13
IUPAC Name2-hydroxyethyl(trimethyl)azanium;hydroxylamine
SMILESC[N+](C)(C)CCO.NO
InChIInChI=1S/C5H14NO.H3NO/c1-6(2,3)4-5-7;1-2/h7H,4-5H2,1-3H3;2H,1H2/q+1;
InChIKeyYZJXKDOIZCRGJY-UHFFFAOYSA-N
XLogP-0.98
TPSA66.48 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.20
LogP ≤ 5-0.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

deuteride;tetrakis(2-hydroxyethyl(trimethyl)azanium)
CID 141334455
barium(2+);2-hydroxyethyl(trimethyl)azanium
CID 88662937
selanium 2-hydroxyethyl(trimethyl)azanium
CID 57348093
copper 2-hydroxyethyl(trimethyl)azanium
CID 89239745
2-hydroxyethyl(trimethyl)azanium;bromide;dihydrobromide
CID 173388257
2-hydroxyethyl(trimethyl)azanium;molecular oxygen
CID 87859014
2-hydroxyethyl(trimethyl)azanium;hydrochloride;dihydroiodide
CID 175143989
2-hydroxyethyl(trimethyl)azanium;λ2-plumbane;chloride
CID 174998407
2-hydroxyethyl(trimethyl)azanium;urea;hydroxide
CID 175396514
2-hydroxyethyl(trimethyl)azanium;trimethylazanium;dichloride
CID 177256523
hexafluorotitanium(2-);bis(2-hydroxyethyl(trimethyl)azanium)
CID 87573240
2-hydroxyethyl(trimethyl)azanium triiodide
CID 18406425

Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl(trimethyl)azanium;hydroxylamine?
The IUPAC name of 2-hydroxyethyl(trimethyl)azanium;hydroxylamine (CID 86628599) is 2-hydroxyethyl(trimethyl)azanium;hydroxylamine.
What is the SMILES notation for 2-hydroxyethyl(trimethyl)azanium;hydroxylamine?
The canonical SMILES for 2-hydroxyethyl(trimethyl)azanium;hydroxylamine is C[N+](C)(C)CCO.NO.
What is the InChIKey of 2-hydroxyethyl(trimethyl)azanium;hydroxylamine?
The InChIKey is YZJXKDOIZCRGJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14NO.H3NO/c1-6(2,3)4-5-7;1-2/h7H,4-5H2,1-3H3;2H,1H2/q+1;.
What are the key properties of 2-hydroxyethyl(trimethyl)azanium;hydroxylamine?
2-hydroxyethyl(trimethyl)azanium;hydroxylamine has a molecular weight of 137.20 g/mol, XLogP of -0.98, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl(trimethyl)azanium;hydroxylamine is sourced from PubChem (CID 86628599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).