2-aminoacetic acid;2-ethenoxyethanamine

C6H14N2O3 — CID 174772659

IUPAC2-aminoacetic acid;2-ethenoxyethanamine
SMILESC=COCCN.NCC(=O)O
InChIInChI=1S/C4H9NO.C2H5NO2/c1-2-6-4-3-5;3-1-2(4)5/h2H,1,3-5H2;1,3H2,(H,4,5)
InChIKeyJVPFRJIBJAHBPQ-UHFFFAOYSA-N
MW162.19 g/mol
LogP-0.87
Rot. Bonds4

About 2-aminoacetic acid;2-ethenoxyethanamine

2-aminoacetic acid;2-ethenoxyethanamine (PubChem CID 174772659) has the molecular formula C6H14N2O3 and a molecular weight of 162.19 g/mol. Its IUPAC name is 2-aminoacetic acid;2-ethenoxyethanamine.

Molecular Properties

Compound Name2-aminoacetic acid;2-ethenoxyethanamine
PubChem CID174772659
Molecular FormulaC6H14N2O3
Molecular Weight162.19 g/mol
Exact Mass162.10
IUPAC Name2-aminoacetic acid;2-ethenoxyethanamine
SMILESC=COCCN.NCC(=O)O
InChIInChI=1S/C4H9NO.C2H5NO2/c1-2-6-4-3-5;3-1-2(4)5/h2H,1,3-5H2;1,3H2,(H,4,5)
InChIKeyJVPFRJIBJAHBPQ-UHFFFAOYSA-N
XLogP-0.87
TPSA98.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 5-0.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-aminoacetic acid;2-ethenoxyethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-aminoacetic acid;2-ethenoxyethanamine?
The IUPAC name of 2-aminoacetic acid;2-ethenoxyethanamine (CID 174772659) is 2-aminoacetic acid;2-ethenoxyethanamine.
What is the SMILES notation for 2-aminoacetic acid;2-ethenoxyethanamine?
The canonical SMILES for 2-aminoacetic acid;2-ethenoxyethanamine is C=COCCN.NCC(=O)O.
What is the InChIKey of 2-aminoacetic acid;2-ethenoxyethanamine?
The InChIKey is JVPFRJIBJAHBPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.C2H5NO2/c1-2-6-4-3-5;3-1-2(4)5/h2H,1,3-5H2;1,3H2,(H,4,5).
What are the key properties of 2-aminoacetic acid;2-ethenoxyethanamine?
2-aminoacetic acid;2-ethenoxyethanamine has a molecular weight of 162.19 g/mol, XLogP of -0.87, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoacetic acid;2-ethenoxyethanamine is sourced from PubChem (CID 174772659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).