N-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide

C18H19ClN2O2 — CID 7699104

IUPACN-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide
SMILESCCc1ccc(/C=N\OCC(=O)NCc2cccc(Cl)c2)cc1
InChIInChI=1S/C18H19ClN2O2/c1-2-14-6-8-15(9-7-14)12-21-23-13-18(22)20-11-16-4-3-5-17(19)10-16/h3-10,12H,2,11,13H2,1H3,(H,20,22)/b21-12-
InChIKeySNLDJSMDZJQSKL-MTJSOVHGSA-N
MW330.82 g/mol
LogP3.57
Rot. Bonds7

About N-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide

N-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide (PubChem CID 7699104) has the molecular formula C18H19ClN2O2 and a molecular weight of 330.82 g/mol. Its IUPAC name is N-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide.

Molecular Properties

Compound NameN-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide
PubChem CID7699104
Molecular FormulaC18H19ClN2O2
Molecular Weight330.82 g/mol
Exact Mass330.11
IUPAC NameN-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide
SMILESCCc1ccc(/C=N\OCC(=O)NCc2cccc(Cl)c2)cc1
InChIInChI=1S/C18H19ClN2O2/c1-2-14-6-8-15(9-7-14)12-21-23-13-18(22)20-11-16-4-3-5-17(19)10-16/h3-10,12H,2,11,13H2,1H3,(H,20,22)/b21-12-
InChIKeySNLDJSMDZJQSKL-MTJSOVHGSA-N
XLogP3.57
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.82
LogP ≤ 53.57
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

N-[(3-chlorophenyl)methyl]-2-[(4-morpholin-4-ylphenyl)methylideneamino]oxyacetamide
CID 78766726
2-[(E)-benzylideneamino]oxy-N-[(3-methoxyphenyl)methyl]acetamide
CID 24606299
N-[(3-chlorophenyl)methyl]-2-methoxyacetamide
CID 60636717
N-[(3-chlorophenyl)methyl]propanamide
CID 17071125
ethyl 3-[(3-chlorophenyl)methylamino]-3-oxopropanoate
CID 154305485
N-(2-chloro-4-methylphenyl)-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide
CID 7698913
4-O-[2-[(3-chlorophenyl)methylamino]-2-oxoethyl] 1-O-ethyl (E)-but-2-enedioate
CID 7851537
2-[(E)-(4-tert-butylphenyl)methylideneamino]oxy-N-[(2,4-dichlorophenyl)methyl]acetamide
CID 6905651
N-cyclopropyl-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide
CID 7698887
N-[(4-methoxyphenyl)methyl]-2-[(Z)-(4-methylphenyl)methylideneamino]oxyacetamide
CID 7705410
2-[2-[(3-chlorophenyl)methylamino]-2-oxoethoxy]acetic acid
CID 60708141
2-(3-chlorophenoxy)-N-[(3-chlorophenyl)methyl]acetamide
CID 2632938

Frequently Asked Questions

What is the IUPAC name of N-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide?
The IUPAC name of N-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide (CID 7699104) is N-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide.
What is the SMILES notation for N-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide?
The canonical SMILES for N-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide is CCc1ccc(/C=N\OCC(=O)NCc2cccc(Cl)c2)cc1.
What is the InChIKey of N-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide?
The InChIKey is SNLDJSMDZJQSKL-MTJSOVHGSA-N. The full InChI is InChI=1S/C18H19ClN2O2/c1-2-14-6-8-15(9-7-14)12-21-23-13-18(22)20-11-16-4-3-5-17(19)10-16/h3-10,12H,2,11,13H2,1H3,(H,20,22)/b21-12-.
What are the key properties of N-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide?
N-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide has a molecular weight of 330.82 g/mol, XLogP of 3.57, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-chlorophenyl)methyl]-2-[(Z)-(4-ethylphenyl)methylideneamino]oxyacetamide is sourced from PubChem (CID 7699104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).