4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide

C16H16N2O3 — CID 135472605

IUPAC4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide
SMILESCCOc1ccc(C(=O)N/N=C/c2ccc(O)cc2)cc1
InChIInChI=1S/C16H16N2O3/c1-2-21-15-9-5-13(6-10-15)16(20)18-17-11-12-3-7-14(19)8-4-12/h3-11,19H,2H2,1H3,(H,18,20)/b17-11+
InChIKeyDWHZRAVDXUWBDD-GZTJUZNOSA-N
MW284.32 g/mol
LogP2.55
Rot. Bonds5

About 4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide

4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide (PubChem CID 135472605) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is 4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide.

Molecular Properties

Compound Name4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide
PubChem CID135472605
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC Name4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide
SMILESCCOc1ccc(C(=O)N/N=C/c2ccc(O)cc2)cc1
InChIInChI=1S/C16H16N2O3/c1-2-21-15-9-5-13(6-10-15)16(20)18-17-11-12-3-7-14(19)8-4-12/h3-11,19H,2H2,1H3,(H,18,20)/b17-11+
InChIKeyDWHZRAVDXUWBDD-GZTJUZNOSA-N
XLogP2.55
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', '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

1-N,4-N-bis[(4-ethoxyphenyl)methylideneamino]benzene-1,4-dicarboxamide
CID 4674929
4-[(4-ethoxyphenoxy)methyl]-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide
CID 135849467
4-ethoxy-N-[(4-methylphenyl)methylideneamino]benzamide
CID 4249365
4-chloro-N-[(Z)-(4-ethoxyphenyl)methylideneamino]benzamide
CID 5402776
N-[(4-tert-butylphenyl)methylideneamino]-4-ethoxybenzamide
CID 4132757
N-[(Z)-(3,4-dihydroxyphenyl)methylideneamino]-4-ethoxybenzamide
CID 136671572
N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-prop-2-enoxybenzamide
CID 135588976
4-hydroxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide;methanol
CID 139076899
N-[(Z)-(4-ethoxyphenyl)methylideneamino]-4-nitrobenzamide
CID 5418193
4-propoxy-N-[(E)-(4-propoxyphenyl)methylideneamino]benzamide
CID 133169717
[4-[(Z)-(benzoylhydrazinylidene)methyl]phenyl] 4-ethoxybenzoate
CID 6241876
4-hydroxy-N-[(Z)-(4-propan-2-yloxyphenyl)methylideneamino]benzamide
CID 112537987

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide?
The IUPAC name of 4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide (CID 135472605) is 4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide.
What is the SMILES notation for 4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide?
The canonical SMILES for 4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide is CCOc1ccc(C(=O)N/N=C/c2ccc(O)cc2)cc1.
What is the InChIKey of 4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide?
The InChIKey is DWHZRAVDXUWBDD-GZTJUZNOSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-2-21-15-9-5-13(6-10-15)16(20)18-17-11-12-3-7-14(19)8-4-12/h3-11,19H,2H2,1H3,(H,18,20)/b17-11+.
What are the key properties of 4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide?
4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide has a molecular weight of 284.32 g/mol, XLogP of 2.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide is sourced from PubChem (CID 135472605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).