N-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide

C16H15ClN2O3 — CID 7664020

IUPACN-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide
SMILESCOc1ccccc1/C=N\OCC(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C16H15ClN2O3/c1-21-15-8-3-2-5-12(15)10-18-22-11-16(20)19-14-7-4-6-13(17)9-14/h2-10H,11H2,1H3,(H,19,20)/b18-10-
InChIKeyBTQZGYARBGOLLW-ZDLGFXPLSA-N
MW318.76 g/mol
LogP3.34
Rot. Bonds6

About N-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide

N-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide (PubChem CID 7664020) has the molecular formula C16H15ClN2O3 and a molecular weight of 318.76 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide
PubChem CID7664020
Molecular FormulaC16H15ClN2O3
Molecular Weight318.76 g/mol
Exact Mass318.08
IUPAC NameN-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide
SMILESCOc1ccccc1/C=N\OCC(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C16H15ClN2O3/c1-21-15-8-3-2-5-12(15)10-18-22-11-16(20)19-14-7-4-6-13(17)9-14/h2-10H,11H2,1H3,(H,19,20)/b18-10-
InChIKeyBTQZGYARBGOLLW-ZDLGFXPLSA-N
XLogP3.34
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.76
LogP ≤ 53.34
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 N-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide?
The IUPAC name of N-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide (CID 7664020) is N-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide is COc1ccccc1/C=N\OCC(=O)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide?
The InChIKey is BTQZGYARBGOLLW-ZDLGFXPLSA-N. The full InChI is InChI=1S/C16H15ClN2O3/c1-21-15-8-3-2-5-12(15)10-18-22-11-16(20)19-14-7-4-6-13(17)9-14/h2-10H,11H2,1H3,(H,19,20)/b18-10-.
What are the key properties of N-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide?
N-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide has a molecular weight of 318.76 g/mol, XLogP of 3.34, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide is sourced from PubChem (CID 7664020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).