N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide

C17H18N2O3 — CID 54777323

IUPACN-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide
SMILESC/C(=N/NC(=O)COc1ccccc1C)c1cccc(O)c1
InChIInChI=1S/C17H18N2O3/c1-12-6-3-4-9-16(12)22-11-17(21)19-18-13(2)14-7-5-8-15(20)10-14/h3-10,20H,11H2,1-2H3,(H,19,21)/b18-13-
InChIKeyICCUIDNHYLRJLZ-AQTBWJFISA-N
MW298.34 g/mol
LogP2.62
Rot. Bonds5

About N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide

N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide (PubChem CID 54777323) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide
PubChem CID54777323
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC NameN-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide
SMILESC/C(=N/NC(=O)COc1ccccc1C)c1cccc(O)c1
InChIInChI=1S/C17H18N2O3/c1-12-6-3-4-9-16(12)22-11-17(21)19-18-13(2)14-7-5-8-15(20)10-14/h3-10,20H,11H2,1-2H3,(H,19,21)/b18-13-
InChIKeyICCUIDNHYLRJLZ-AQTBWJFISA-N
XLogP2.62
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.62
H-Bond Donors ≤ 52
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-(2-methylphenoxy)-N-[(E)-1-(3-nitrophenyl)ethylideneamino]acetamide
CID 5404940
N-[(E)-1-(4-aminophenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide
CID 5428196
N,N'-bis[(E)-1-(3-hydroxyphenyl)ethylideneamino]propanediamide
CID 172984598
2-(4-chlorophenoxy)-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]acetamide
CID 6062096
2-(2,5-dimethylphenoxy)-N-(1-phenylethylideneamino)acetamide
CID 958391
2-naphthalen-1-yloxy-N-[(Z)-1-phenylethylideneamino]acetamide
CID 5404956
ethyl 4-[2-[(2Z)-2-[1-(3-hydroxyphenyl)ethylidene]hydrazinyl]-2-oxoethoxy]benzoate
CID 54777648
N-[1-(3-aminophenyl)ethylideneamino]-2-naphthalen-1-yloxyacetamide
CID 922110
2-(2,3-dimethylphenoxy)-N-[(E)-1-(3-nitrophenyl)ethylideneamino]acetamide
CID 23010565
N-[(Z)-1-(3-aminophenyl)ethylideneamino]-2-(2-methoxyphenoxy)acetamide
CID 5419932
N,N'-bis[1-(3-hydroxyphenyl)ethylideneamino]pentanediamide
CID 4204906
N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]butanamide
CID 54777662

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide (CID 54777323) is N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide is C/C(=N/NC(=O)COc1ccccc1C)c1cccc(O)c1.
What is the InChIKey of N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide?
The InChIKey is ICCUIDNHYLRJLZ-AQTBWJFISA-N. The full InChI is InChI=1S/C17H18N2O3/c1-12-6-3-4-9-16(12)22-11-17(21)19-18-13(2)14-7-5-8-15(20)10-14/h3-10,20H,11H2,1-2H3,(H,19,21)/b18-13-.
What are the key properties of N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide?
N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide has a molecular weight of 298.34 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 54777323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).