2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide

C17H16Cl2N2O3 — CID 7701196

IUPAC2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)CO/N=C\c1cccc(Cl)c1Cl
InChIInChI=1S/C17H16Cl2N2O3/c1-11-6-7-15(23-2)14(8-11)21-16(22)10-24-20-9-12-4-3-5-13(18)17(12)19/h3-9H,10H2,1-2H3,(H,21,22)/b20-9-
InChIKeyUKZDGOOEZBORJM-UKWGHVSLSA-N
MW367.23 g/mol
LogP4.30
Rot. Bonds6

About 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide

2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide (PubChem CID 7701196) has the molecular formula C17H16Cl2N2O3 and a molecular weight of 367.23 g/mol. Its IUPAC name is 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide
PubChem CID7701196
Molecular FormulaC17H16Cl2N2O3
Molecular Weight367.23 g/mol
Exact Mass366.05
IUPAC Name2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)CO/N=C\c1cccc(Cl)c1Cl
InChIInChI=1S/C17H16Cl2N2O3/c1-11-6-7-15(23-2)14(8-11)21-16(22)10-24-20-9-12-4-3-5-13(18)17(12)19/h3-9H,10H2,1-2H3,(H,21,22)/b20-9-
InChIKeyUKZDGOOEZBORJM-UKWGHVSLSA-N
XLogP4.30
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.23
LogP ≤ 54.30
H-Bond Donors ≤ 51
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'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide?
The IUPAC name of 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide (CID 7701196) is 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide.
What is the SMILES notation for 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide?
The canonical SMILES for 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide is COc1ccc(C)cc1NC(=O)CO/N=C\c1cccc(Cl)c1Cl.
What is the InChIKey of 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide?
The InChIKey is UKZDGOOEZBORJM-UKWGHVSLSA-N. The full InChI is InChI=1S/C17H16Cl2N2O3/c1-11-6-7-15(23-2)14(8-11)21-16(22)10-24-20-9-12-4-3-5-13(18)17(12)19/h3-9H,10H2,1-2H3,(H,21,22)/b20-9-.
What are the key properties of 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide?
2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide has a molecular weight of 367.23 g/mol, XLogP of 4.30, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-(2,3-dichlorophenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide is sourced from PubChem (CID 7701196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).