2-amino-N-propoxyacetamide

C5H12N2O2 — CID 55284447

IUPAC2-amino-N-propoxyacetamide
SMILESCCCONC(=O)CN
InChIInChI=1S/C5H12N2O2/c1-2-3-9-7-5(8)4-6/h2-4,6H2,1H3,(H,7,8)
InChIKeyAZJHPQNOYVURFP-UHFFFAOYSA-N
MW132.16 g/mol
LogP-0.60
Rot. Bonds4

About 2-amino-N-propoxyacetamide

2-amino-N-propoxyacetamide (PubChem CID 55284447) has the molecular formula C5H12N2O2 and a molecular weight of 132.16 g/mol. Its IUPAC name is 2-amino-N-propoxyacetamide.

Molecular Properties

Compound Name2-amino-N-propoxyacetamide
PubChem CID55284447
Molecular FormulaC5H12N2O2
Molecular Weight132.16 g/mol
Exact Mass132.09
IUPAC Name2-amino-N-propoxyacetamide
SMILESCCCONC(=O)CN
InChIInChI=1S/C5H12N2O2/c1-2-3-9-7-5(8)4-6/h2-4,6H2,1H3,(H,7,8)
InChIKeyAZJHPQNOYVURFP-UHFFFAOYSA-N
XLogP-0.60
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.16
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-propoxyacetamide?
The IUPAC name of 2-amino-N-propoxyacetamide (CID 55284447) is 2-amino-N-propoxyacetamide.
What is the SMILES notation for 2-amino-N-propoxyacetamide?
The canonical SMILES for 2-amino-N-propoxyacetamide is CCCONC(=O)CN.
What is the InChIKey of 2-amino-N-propoxyacetamide?
The InChIKey is AZJHPQNOYVURFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O2/c1-2-3-9-7-5(8)4-6/h2-4,6H2,1H3,(H,7,8).
What are the key properties of 2-amino-N-propoxyacetamide?
2-amino-N-propoxyacetamide has a molecular weight of 132.16 g/mol, XLogP of -0.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-propoxyacetamide is sourced from PubChem (CID 55284447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).