2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide

C16H14Cl2N2O2 — CID 7701194

IUPAC2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CO/N=C\c2cccc(Cl)c2Cl)c1
InChIInChI=1S/C16H14Cl2N2O2/c1-11-4-2-6-13(8-11)20-15(21)10-22-19-9-12-5-3-7-14(17)16(12)18/h2-9H,10H2,1H3,(H,20,21)/b19-9-
InChIKeyAYAFFAMHFWHMFL-OCKHKDLRSA-N
MW337.21 g/mol
LogP4.29
Rot. Bonds5

About 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide

2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide (PubChem CID 7701194) has the molecular formula C16H14Cl2N2O2 and a molecular weight of 337.21 g/mol. Its IUPAC name is 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide
PubChem CID7701194
Molecular FormulaC16H14Cl2N2O2
Molecular Weight337.21 g/mol
Exact Mass336.04
IUPAC Name2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CO/N=C\c2cccc(Cl)c2Cl)c1
InChIInChI=1S/C16H14Cl2N2O2/c1-11-4-2-6-13(8-11)20-15(21)10-22-19-9-12-5-3-7-14(17)16(12)18/h2-9H,10H2,1H3,(H,20,21)/b19-9-
InChIKeyAYAFFAMHFWHMFL-OCKHKDLRSA-N
XLogP4.29
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.21
LogP ≤ 54.29
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'}

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Related Compounds

2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide
CID 7701196
N-(4-chloro-2-methylphenyl)-2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxyacetamide
CID 7701325
N-(3-methylphenyl)-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide
CID 78767132
2-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]oxy-N-(3-methylphenyl)acetamide
CID 7644292
N-(3-bromophenyl)-2-[(Z)-(2-methylphenyl)methylideneamino]oxyacetamide
CID 7670074
N-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide
CID 7664020
2-[(Z)-(3-chloro-4-ethoxy-5-methoxyphenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide
CID 7706853
N-(3-chlorophenyl)-2-[(Z)-(2-fluorophenyl)methylideneamino]oxyacetamide
CID 7703265
[2-(3-methylanilino)-2-oxoethyl] 2-chlorobenzoate
CID 2624326
N-benzyl-2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxyacetamide
CID 7701233
2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(propylcarbamoyl)acetamide
CID 7701446
N-(3-ethylphenyl)-2-[(Z)-(2-methylphenyl)methylideneamino]oxyacetamide
CID 7670270

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide (CID 7701194) is 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide is Cc1cccc(NC(=O)CO/N=C\c2cccc(Cl)c2Cl)c1.
What is the InChIKey of 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide?
The InChIKey is AYAFFAMHFWHMFL-OCKHKDLRSA-N. The full InChI is InChI=1S/C16H14Cl2N2O2/c1-11-4-2-6-13(8-11)20-15(21)10-22-19-9-12-5-3-7-14(17)16(12)18/h2-9H,10H2,1H3,(H,20,21)/b19-9-.
What are the key properties of 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide?
2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide has a molecular weight of 337.21 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 7701194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).