2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide

C15H21N3O3 — CID 7699310

IUPAC2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide
SMILESCCCNC(=O)NC(=O)CO/N=C\c1ccc(CC)cc1
InChIInChI=1S/C15H21N3O3/c1-3-9-16-15(20)18-14(19)11-21-17-10-13-7-5-12(4-2)6-8-13/h5-8,10H,3-4,9,11H2,1-2H3,(H2,16,18,19,20)/b17-10-
InChIKeyNCIZQSBCJFAVMY-YVLHZVERSA-N
MW291.35 g/mol
LogP1.84
Rot. Bonds7

About 2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide

2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide (PubChem CID 7699310) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide
PubChem CID7699310
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide
SMILESCCCNC(=O)NC(=O)CO/N=C\c1ccc(CC)cc1
InChIInChI=1S/C15H21N3O3/c1-3-9-16-15(20)18-14(19)11-21-17-10-13-7-5-12(4-2)6-8-13/h5-8,10H,3-4,9,11H2,1-2H3,(H2,16,18,19,20)/b17-10-
InChIKeyNCIZQSBCJFAVMY-YVLHZVERSA-N
XLogP1.84
TPSA79.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide 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

2-[(Z)-(3-fluorophenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide
CID 7704785
N-(butylcarbamoyl)-2-[(Z)-(4-ethoxyphenyl)methylideneamino]oxyacetamide
CID 9354539
[2-oxo-2-(propylcarbamoylamino)ethyl] 4-ethylbenzoate
CID 2607035
N-cyclopropyl-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide
CID 7698887
2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide
CID 7701446
methyl 4-[(E)-[2-(4-ethylanilino)-2-oxoethoxy]iminomethyl]benzoate
CID 42967708
N-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide
CID 7699104
N-(2-chloro-4-methylphenyl)-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide
CID 7698913
methyl 4-[[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethoxy]iminomethyl]benzoate
CID 2110077
methyl 4-[(E)-[2-oxo-2-(4-propylanilino)ethoxy]iminomethyl]benzoate
CID 24581694
N-[(4-methoxyphenyl)methyl]-2-[(Z)-(4-methylphenyl)methylideneamino]oxyacetamide
CID 7705410
2-[(Z)-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylideneamino]oxy-N-(ethylcarbamoyl)acetamide
CID 7642554

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide?
The IUPAC name of 2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide (CID 7699310) is 2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide.
What is the SMILES notation for 2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide?
The canonical SMILES for 2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide is CCCNC(=O)NC(=O)CO/N=C\c1ccc(CC)cc1.
What is the InChIKey of 2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide?
The InChIKey is NCIZQSBCJFAVMY-YVLHZVERSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-3-9-16-15(20)18-14(19)11-21-17-10-13-7-5-12(4-2)6-8-13/h5-8,10H,3-4,9,11H2,1-2H3,(H2,16,18,19,20)/b17-10-.
What are the key properties of 2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide?
2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide has a molecular weight of 291.35 g/mol, XLogP of 1.84, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-(4-ethylphenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide is sourced from PubChem (CID 7699310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).