N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide

C11H14N2O3 — CID 135767611

IUPACN-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide
SMILESCOc1ccc(/C(C)=N/NC(C)=O)c(O)c1
InChIInChI=1S/C11H14N2O3/c1-7(12-13-8(2)14)10-5-4-9(16-3)6-11(10)15/h4-6,15H,1-3H3,(H,13,14)/b12-7+
InChIKeyNKUGAVSJOWLSAA-KPKJPENVSA-N
MW222.24 g/mol
LogP1.26
Rot. Bonds3

About N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide

N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide (PubChem CID 135767611) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide.

Molecular Properties

Compound NameN-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide
PubChem CID135767611
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC NameN-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide
SMILESCOc1ccc(/C(C)=N/NC(C)=O)c(O)c1
InChIInChI=1S/C11H14N2O3/c1-7(12-13-8(2)14)10-5-4-9(16-3)6-11(10)15/h4-6,15H,1-3H3,(H,13,14)/b12-7+
InChIKeyNKUGAVSJOWLSAA-KPKJPENVSA-N
XLogP1.26
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(Z)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]-2-(4-methoxyphenoxy)acetamide
CID 136690202
N-[(E)-1-(2,4-dihydroxyphenyl)ethylideneamino]-4-methoxybenzamide
CID 135738429
N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]thiophene-2-carboxamide
CID 135685177
2-hydroxy-4-methoxy-N-[(Z)-1-phenylethylideneamino]benzamide
CID 126396445
1-ethyl-3-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]thiourea
CID 135751899
2-[(Z)-N-hydroxy-C-methylcarbonimidoyl]-5-methoxyphenol
CID 137082808
2-hydroxy-4-methoxy-N-[(Z)-1-naphthalen-1-ylethylideneamino]benzamide
CID 126397741
4-[(4-ethoxyphenoxy)methyl]-N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]benzamide
CID 135752121
2-(3-fluorophenoxy)-N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide
CID 135557679
N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 135716717
N'-[(E)-1-(2-hydroxy-5-methoxyphenyl)ethylideneamino]-N-propan-2-yloxamide
CID 135575852
2-[(E)-N-(4-chloroanilino)-C-methylcarbonimidoyl]-5-methoxyphenol;hydrochloride
CID 135675803

Frequently Asked Questions

What is the IUPAC name of N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide?
The IUPAC name of N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide (CID 135767611) is N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide.
What is the SMILES notation for N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide?
The canonical SMILES for N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide is COc1ccc(/C(C)=N/NC(C)=O)c(O)c1.
What is the InChIKey of N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide?
The InChIKey is NKUGAVSJOWLSAA-KPKJPENVSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-7(12-13-8(2)14)10-5-4-9(16-3)6-11(10)15/h4-6,15H,1-3H3,(H,13,14)/b12-7+.
What are the key properties of N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide?
N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide has a molecular weight of 222.24 g/mol, XLogP of 1.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide is sourced from PubChem (CID 135767611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).