N,N-diethylhydroxylamine;2-hydroxyacetic acid

C6H15NO4 — CID 173174069

IUPACN,N-diethylhydroxylamine;2-hydroxyacetic acid
SMILESCCN(O)CC.O=C(O)CO
InChIInChI=1S/C4H11NO.C2H4O3/c1-3-5(6)4-2;3-1-2(4)5/h6H,3-4H2,1-2H3;3H,1H2,(H,4,5)
InChIKeyXCZSAORBPCKBLS-UHFFFAOYSA-N
MW165.19 g/mol
LogP-0.22
Rot. Bonds3

About N,N-diethylhydroxylamine;2-hydroxyacetic acid

N,N-diethylhydroxylamine;2-hydroxyacetic acid (PubChem CID 173174069) has the molecular formula C6H15NO4 and a molecular weight of 165.19 g/mol. Its IUPAC name is N,N-diethylhydroxylamine;2-hydroxyacetic acid.

Molecular Properties

Compound NameN,N-diethylhydroxylamine;2-hydroxyacetic acid
PubChem CID173174069
Molecular FormulaC6H15NO4
Molecular Weight165.19 g/mol
Exact Mass165.10
IUPAC NameN,N-diethylhydroxylamine;2-hydroxyacetic acid
SMILESCCN(O)CC.O=C(O)CO
InChIInChI=1S/C4H11NO.C2H4O3/c1-3-5(6)4-2;3-1-2(4)5/h6H,3-4H2,1-2H3;3H,1H2,(H,4,5)
InChIKeyXCZSAORBPCKBLS-UHFFFAOYSA-N
XLogP-0.22
TPSA81.00 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.19
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

sodium;N,N-diethylhydroxylamine;hydride
CID 173441828
tetrakis(2-hydroxyacetic acid);silane
CID 173225780
bis(2-hydroxyacetic acid);methane
CID 158039555
CID 88684247
CID 88684247
acetic acid;2-hydroxyacetic acid;propanoic acid
CID 174880739
2-hydroxyacetic acid;methoxymethane
CID 87581490
2-hydroxyacetic acid;silane;zirconium
CID 174940076
dioxidanium;bis(2-hydroxyacetic acid);manganese
CID 5232950
benzene;2-hydroxyacetic acid
CID 67764636
azane;2-hydroxyacetic acid;zirconium
CID 173458110
heptakis(2-hydroxyacetic acid);yttrium;zirconium
CID 154733245
acetylene;2-hydroxyacetic acid
CID 158693227

Frequently Asked Questions

What is the IUPAC name of N,N-diethylhydroxylamine;2-hydroxyacetic acid?
The IUPAC name of N,N-diethylhydroxylamine;2-hydroxyacetic acid (CID 173174069) is N,N-diethylhydroxylamine;2-hydroxyacetic acid.
What is the SMILES notation for N,N-diethylhydroxylamine;2-hydroxyacetic acid?
The canonical SMILES for N,N-diethylhydroxylamine;2-hydroxyacetic acid is CCN(O)CC.O=C(O)CO.
What is the InChIKey of N,N-diethylhydroxylamine;2-hydroxyacetic acid?
The InChIKey is XCZSAORBPCKBLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NO.C2H4O3/c1-3-5(6)4-2;3-1-2(4)5/h6H,3-4H2,1-2H3;3H,1H2,(H,4,5).
What are the key properties of N,N-diethylhydroxylamine;2-hydroxyacetic acid?
N,N-diethylhydroxylamine;2-hydroxyacetic acid has a molecular weight of 165.19 g/mol, XLogP of -0.22, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylhydroxylamine;2-hydroxyacetic acid is sourced from PubChem (CID 173174069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).