2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide

C20H24N2O2 — CID 137268673

IUPAC2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide
SMILESC/C(=N\NC(=O)Cc1ccc(C)cc1C)c1cc(C)c(O)c(C)c1
InChIInChI=1S/C20H24N2O2/c1-12-6-7-17(13(2)8-12)11-19(23)22-21-16(5)18-9-14(3)20(24)15(4)10-18/h6-10,24H,11H2,1-5H3,(H,22,23)/b21-16+
InChIKeyHQIIAUJAFFGZEA-LTGZKZEYSA-N
MW324.42 g/mol
LogP3.71
Rot. Bonds4

About 2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide

2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide (PubChem CID 137268673) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide.

Molecular Properties

Compound Name2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide
PubChem CID137268673
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide
SMILESC/C(=N\NC(=O)Cc1ccc(C)cc1C)c1cc(C)c(O)c(C)c1
InChIInChI=1S/C20H24N2O2/c1-12-6-7-17(13(2)8-12)11-19(23)22-21-16(5)18-9-14(3)20(24)15(4)10-18/h6-10,24H,11H2,1-5H3,(H,22,23)/b21-16+
InChIKeyHQIIAUJAFFGZEA-LTGZKZEYSA-N
XLogP3.71
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

N-[(E)-(5,7-dimethyl-3,4-dihydro-2H-naphthalen-1-ylidene)amino]-4-hydroxybenzamide
CID 9684188
N'-[(1E)-1-(4-hydroxyphenyl)ethylidene]-2,2-diphenylacetohydrazide
CID 135603353
N'-[1-(2,4-dihydroxyphenyl)ethylidene]octanohydrazide
CID 135401351
trans-(1R,2R)-N-[(E)-1-(3-hydroxyphenyl)ethylideneamino]-2-phenylcyclopropane-1-carboxamide
CID 73349388
2-(4-fluorophenyl)-N'-[(1E)-1-(4-hydroxyphenyl)ethylidene]acetohydrazide
CID 135472799
trans-(1R,2R)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]-2-phenylcyclopropane-1-carboxamide
CID 135907423
trans-(1R,2R)-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-phenylcyclopropane-1-carboxamide
CID 136254460
N'-[1-(2,4-dihydroxyphenyl)ethylidene]nonanohydrazide
CID 135401352
3-fluoro-N'-(6-hydroxy-7-methyl-3,4-dihydro-1(2H)-naphthalenylidene)benzohydrazide
CID 135438759
N'-[1-(2-hydroxyphenyl)ethylidene]-4-biphenylcarbohydrazide
CID 135472550
N-[(E)-1-(2-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide
CID 135616066
4-tert-butyl-N'-[(E)-(2-hydroxy-5-methylphenyl)methylidene]benzohydrazide
CID 135642920

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide?
The IUPAC name of 2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide (CID 137268673) is 2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide.
What is the SMILES notation for 2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide?
The canonical SMILES for 2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide is C/C(=N\NC(=O)Cc1ccc(C)cc1C)c1cc(C)c(O)c(C)c1.
What is the InChIKey of 2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide?
The InChIKey is HQIIAUJAFFGZEA-LTGZKZEYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-12-6-7-17(13(2)8-12)11-19(23)22-21-16(5)18-9-14(3)20(24)15(4)10-18/h6-10,24H,11H2,1-5H3,(H,22,23)/b21-16+.
What are the key properties of 2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide?
2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide has a molecular weight of 324.42 g/mol, XLogP of 3.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenyl)-N-[(E)-1-(4-hydroxy-3,5-dimethylphenyl)ethylideneamino]acetamide is sourced from PubChem (CID 137268673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).