2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide

C21H17ClN2O3 — CID 7700764

IUPAC2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide
SMILESO=C(CO/N=C\c1ccc(Cl)cc1)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C21H17ClN2O3/c22-17-12-10-16(11-13-17)14-23-26-15-21(25)24-19-8-4-5-9-20(19)27-18-6-2-1-3-7-18/h1-14H,15H2,(H,24,25)/b23-14-
InChIKeyXGRRLHDPEISUSW-UCQKPKSFSA-N
MW380.83 g/mol
LogP5.12
Rot. Bonds7

About 2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide

2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide (PubChem CID 7700764) has the molecular formula C21H17ClN2O3 and a molecular weight of 380.83 g/mol. Its IUPAC name is 2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide
PubChem CID7700764
Molecular FormulaC21H17ClN2O3
Molecular Weight380.83 g/mol
Exact Mass380.09
IUPAC Name2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide
SMILESO=C(CO/N=C\c1ccc(Cl)cc1)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C21H17ClN2O3/c22-17-12-10-16(11-13-17)14-23-26-15-21(25)24-19-8-4-5-9-20(19)27-18-6-2-1-3-7-18/h1-14H,15H2,(H,24,25)/b23-14-
InChIKeyXGRRLHDPEISUSW-UCQKPKSFSA-N
XLogP5.12
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.83
LogP ≤ 55.12
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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Related Compounds

2-[(4-chlorophenyl)methylideneamino]oxy-N-phenylacetamide
CID 2430181
N-(2-methoxyphenyl)-2-[(Z)-(4-methoxyphenyl)methylideneamino]oxyacetamide
CID 6219592
2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2,4-dimethoxyphenyl)acetamide
CID 7700967
2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2,6-dimethylphenyl)acetamide
CID 7700741
2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide
CID 108998186
[2-oxo-2-(2-phenoxyanilino)ethyl] (E)-3-phenylprop-2-enoate
CID 7860923
2-(4-chlorophenoxy)-N-[2-(4-methylphenoxy)phenyl]acetamide
CID 7925670
2-[(E)-(4-fluorophenyl)methylideneamino]oxy-N-phenylacetamide
CID 47096591
2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(3-fluorophenyl)acetamide
CID 7700971
3-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)propanamide
CID 109021922
2-[[4-(dimethylamino)phenyl]methylideneamino]oxy-N-(3-phenoxyphenyl)acetamide
CID 2565865
2-[(E)-[4-(dimethylamino)phenyl]methylideneamino]oxy-N-(3-phenoxyphenyl)acetamide
CID 6907348

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide?
The IUPAC name of 2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide (CID 7700764) is 2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide.
What is the SMILES notation for 2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide?
The canonical SMILES for 2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide is O=C(CO/N=C\c1ccc(Cl)cc1)Nc1ccccc1Oc1ccccc1.
What is the InChIKey of 2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide?
The InChIKey is XGRRLHDPEISUSW-UCQKPKSFSA-N. The full InChI is InChI=1S/C21H17ClN2O3/c22-17-12-10-16(11-13-17)14-23-26-15-21(25)24-19-8-4-5-9-20(19)27-18-6-2-1-3-7-18/h1-14H,15H2,(H,24,25)/b23-14-.
What are the key properties of 2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide?
2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide has a molecular weight of 380.83 g/mol, XLogP of 5.12, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-(4-chlorophenyl)methylideneamino]oxy-N-(2-phenoxyphenyl)acetamide is sourced from PubChem (CID 7700764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).