2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide

C17H19N3O2 — CID 2366807

IUPAC2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide
SMILESCCN(C(=O)CON=C(N)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19N3O2/c1-2-20(15-11-7-4-8-12-15)16(21)13-22-19-17(18)14-9-5-3-6-10-14/h3-12H,2,13H2,1H3,(H2,18,19)
InChIKeyLFKKMGOOCFNBJO-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.38
Rot. Bonds6

About 2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide

2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide (PubChem CID 2366807) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is 2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide.

Molecular Properties

Compound Name2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide
PubChem CID2366807
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Name2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide
SMILESCCN(C(=O)CON=C(N)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19N3O2/c1-2-20(15-11-7-4-8-12-15)16(21)13-22-19-17(18)14-9-5-3-6-10-14/h3-12H,2,13H2,1H3,(H2,18,19)
InChIKeyLFKKMGOOCFNBJO-UHFFFAOYSA-N
XLogP2.38
TPSA67.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide with MolForge

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

Launch Full Analysis

Related Compounds

N-ethyl-2-[2-(N-ethylanilino)-2-oxoethoxy]-N-phenylacetamide
CID 52563694
N,N'-diethyl-N,N'-diphenylpropanediamide
CID 14847934
N-ethyl-4-[(Z)-N'-hydroxycarbamimidoyl]-N-phenylbenzamide
CID 43333185
[2-(N-ethylanilino)-2-oxoethyl] naphthalene-2-carboxylate
CID 2507754
N-ethyl-2-(4-methoxyphenoxy)-N-phenylacetamide
CID 922695
2-[[amino-(6-phenoxy-3-pyridinyl)methylidene]amino]oxy-N-methyl-N-phenylacetamide
CID 75264488
[2-(N-ethylanilino)-2-oxoethyl] 3-phenylpropanoate
CID 2391741
[(Z)-[amino(phenyl)methylidene]amino] propanoate
CID 12649620
2-[4-(aminomethyl)phenoxy]-N-ethyl-N-phenylacetamide
CID 16787196
N-[2-(N-ethylanilino)-2-oxoethyl]benzamide
CID 15890379
[2-(N-ethylanilino)-2-oxoethyl] 3-(4-methoxyphenoxy)propanoate
CID 2375807
2-[(E)-[amino(phenyl)methylidene]amino]oxy-N-(3,5-dimethylphenyl)acetamide
CID 7613256

Frequently Asked Questions

What is the IUPAC name of 2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide?
The IUPAC name of 2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide (CID 2366807) is 2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide.
What is the SMILES notation for 2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide?
The canonical SMILES for 2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide is CCN(C(=O)CON=C(N)c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide?
The InChIKey is LFKKMGOOCFNBJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-2-20(15-11-7-4-8-12-15)16(21)13-22-19-17(18)14-9-5-3-6-10-14/h3-12H,2,13H2,1H3,(H2,18,19).
What are the key properties of 2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide?
2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide has a molecular weight of 297.36 g/mol, XLogP of 2.38, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[amino(phenyl)methylidene]amino]oxy-N-ethyl-N-phenylacetamide is sourced from PubChem (CID 2366807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).