2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide

C19H19ClN2O2 — CID 4666541

IUPAC2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
SMILESO=C(CON=Cc1ccccc1Cl)NC1CCCc2ccccc21
InChIInChI=1S/C19H19ClN2O2/c20-17-10-4-2-7-15(17)12-21-24-13-19(23)22-18-11-5-8-14-6-1-3-9-16(14)18/h1-4,6-7,9-10,12,18H,5,8,11,13H2,(H,22,23)
InChIKeyYIWCTVDIDUKWRT-UHFFFAOYSA-N
MW342.83 g/mol
LogP3.88
Rot. Bonds5

About 2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide

2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide (PubChem CID 4666541) has the molecular formula C19H19ClN2O2 and a molecular weight of 342.83 g/mol. Its IUPAC name is 2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide.

Molecular Properties

Compound Name2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
PubChem CID4666541
Molecular FormulaC19H19ClN2O2
Molecular Weight342.83 g/mol
Exact Mass342.11
IUPAC Name2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
SMILESO=C(CON=Cc1ccccc1Cl)NC1CCCc2ccccc21
InChIInChI=1S/C19H19ClN2O2/c20-17-10-4-2-7-15(17)12-21-24-13-19(23)22-18-11-5-8-14-6-1-3-9-16(14)18/h1-4,6-7,9-10,12,18H,5,8,11,13H2,(H,22,23)
InChIKeyYIWCTVDIDUKWRT-UHFFFAOYSA-N
XLogP3.88
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.83
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)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

(E)-3-(2-chlorophenyl)-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]prop-2-enamide
CID 7919796
N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-2-(2,4,5-trichlorophenoxy)acetamide
CID 2570970
2-(8-chloronaphthalen-1-yl)sulfanyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 11918851
[2-oxo-2-[[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl] (2S)-2-hydroxy-2-phenylacetate
CID 7821281
(E)-3-(2-chlorophenyl)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]prop-2-enamide
CID 94011690
2-(2,6-dichlorophenyl)sulfanyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 2543502
[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl] (2S)-2-[(2-chlorobenzoyl)amino]-3-methylbutanoate
CID 41320142
[2-oxo-2-[[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl] 4-(4-chlorophenyl)-4-oxobutanoate
CID 2521262
[2-oxo-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl] 2-cyclopentylacetate
CID 23848552
2-[(2,6-dichlorophenyl)methylsulfanyl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 30389296
[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl] 4-propan-2-ylbenzoate
CID 2505318
N-(1,2,3,4-tetrahydronaphthalen-1-yl)-2-[(Z)-1-thiophen-2-ylethylideneamino]oxyacetamide
CID 6183388

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The IUPAC name of 2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide (CID 4666541) is 2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide.
What is the SMILES notation for 2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The canonical SMILES for 2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide is O=C(CON=Cc1ccccc1Cl)NC1CCCc2ccccc21.
What is the InChIKey of 2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The InChIKey is YIWCTVDIDUKWRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O2/c20-17-10-4-2-7-15(17)12-21-24-13-19(23)22-18-11-5-8-14-6-1-3-9-16(14)18/h1-4,6-7,9-10,12,18H,5,8,11,13H2,(H,22,23).
What are the key properties of 2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide has a molecular weight of 342.83 g/mol, XLogP of 3.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chlorophenyl)methylideneamino]oxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide is sourced from PubChem (CID 4666541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).