2-[amino(dimethyl)azaniumyl]acetate

C4H10N2O2 — CID 2349379

IUPAC2-[amino(dimethyl)azaniumyl]acetate
SMILESC[N+](C)(N)CC(=O)[O-]
InChIInChI=1S/C4H10N2O2/c1-6(2,5)3-4(7)8/h3,5H2,1-2H3
InChIKeyLIVGBSZVCXBCAN-UHFFFAOYSA-N
MW118.14 g/mol
LogP-2.31
Rot. Bonds2

About 2-[amino(dimethyl)azaniumyl]acetate

2-[amino(dimethyl)azaniumyl]acetate (PubChem CID 2349379) has the molecular formula C4H10N2O2 and a molecular weight of 118.14 g/mol. Its IUPAC name is 2-[amino(dimethyl)azaniumyl]acetate.

Molecular Properties

Compound Name2-[amino(dimethyl)azaniumyl]acetate
PubChem CID2349379
Molecular FormulaC4H10N2O2
Molecular Weight118.14 g/mol
Exact Mass118.07
IUPAC Name2-[amino(dimethyl)azaniumyl]acetate
SMILESC[N+](C)(N)CC(=O)[O-]
InChIInChI=1S/C4H10N2O2/c1-6(2,5)3-4(7)8/h3,5H2,1-2H3
InChIKeyLIVGBSZVCXBCAN-UHFFFAOYSA-N
XLogP-2.31
TPSA66.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.14
LogP ≤ 5-2.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[amino(dimethyl)azaniumyl]acetate?
The IUPAC name of 2-[amino(dimethyl)azaniumyl]acetate (CID 2349379) is 2-[amino(dimethyl)azaniumyl]acetate.
What is the SMILES notation for 2-[amino(dimethyl)azaniumyl]acetate?
The canonical SMILES for 2-[amino(dimethyl)azaniumyl]acetate is C[N+](C)(N)CC(=O)[O-].
What is the InChIKey of 2-[amino(dimethyl)azaniumyl]acetate?
The InChIKey is LIVGBSZVCXBCAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O2/c1-6(2,5)3-4(7)8/h3,5H2,1-2H3.
What are the key properties of 2-[amino(dimethyl)azaniumyl]acetate?
2-[amino(dimethyl)azaniumyl]acetate has a molecular weight of 118.14 g/mol, XLogP of -2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[amino(dimethyl)azaniumyl]acetate is sourced from PubChem (CID 2349379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).