2-(2-aminoethylideneamino)-N-ethylacetamide

C6H13N3O — CID 123817131

IUPAC2-(2-aminoethylideneamino)-N-ethylacetamide
SMILESCCNC(=O)C/N=C/CN
InChIInChI=1S/C6H13N3O/c1-2-9-6(10)5-8-4-3-7/h4H,2-3,5,7H2,1H3,(H,9,10)/b8-4+
InChIKeyJNJMWGNXURQXNG-XBXARRHUSA-N
MW143.19 g/mol
LogP-0.85
Rot. Bonds4

About 2-(2-aminoethylideneamino)-N-ethylacetamide

2-(2-aminoethylideneamino)-N-ethylacetamide (PubChem CID 123817131) has the molecular formula C6H13N3O and a molecular weight of 143.19 g/mol. Its IUPAC name is 2-(2-aminoethylideneamino)-N-ethylacetamide.

Molecular Properties

Compound Name2-(2-aminoethylideneamino)-N-ethylacetamide
PubChem CID123817131
Molecular FormulaC6H13N3O
Molecular Weight143.19 g/mol
Exact Mass143.11
IUPAC Name2-(2-aminoethylideneamino)-N-ethylacetamide
SMILESCCNC(=O)C/N=C/CN
InChIInChI=1S/C6H13N3O/c1-2-9-6(10)5-8-4-3-7/h4H,2-3,5,7H2,1H3,(H,9,10)/b8-4+
InChIKeyJNJMWGNXURQXNG-XBXARRHUSA-N
XLogP-0.85
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethylideneamino)-N-ethylacetamide?
The IUPAC name of 2-(2-aminoethylideneamino)-N-ethylacetamide (CID 123817131) is 2-(2-aminoethylideneamino)-N-ethylacetamide.
What is the SMILES notation for 2-(2-aminoethylideneamino)-N-ethylacetamide?
The canonical SMILES for 2-(2-aminoethylideneamino)-N-ethylacetamide is CCNC(=O)C/N=C/CN.
What is the InChIKey of 2-(2-aminoethylideneamino)-N-ethylacetamide?
The InChIKey is JNJMWGNXURQXNG-XBXARRHUSA-N. The full InChI is InChI=1S/C6H13N3O/c1-2-9-6(10)5-8-4-3-7/h4H,2-3,5,7H2,1H3,(H,9,10)/b8-4+.
What are the key properties of 2-(2-aminoethylideneamino)-N-ethylacetamide?
2-(2-aminoethylideneamino)-N-ethylacetamide has a molecular weight of 143.19 g/mol, XLogP of -0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethylideneamino)-N-ethylacetamide is sourced from PubChem (CID 123817131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).