N-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide

C24H24N2O4 — CID 4863454

IUPACN-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide
SMILESCOc1ccccc1N(Cc1ccccc1O)C(=O)CON=C(C)c1ccccc1
InChIInChI=1S/C24H24N2O4/c1-18(19-10-4-3-5-11-19)25-30-17-24(28)26(16-20-12-6-8-14-22(20)27)21-13-7-9-15-23(21)29-2/h3-15,27H,16-17H2,1-2H3
InChIKeyVNQPNPPZRGQGQX-UHFFFAOYSA-N
MW404.47 g/mol
LogP4.37
Rot. Bonds8

About N-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide

N-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide (PubChem CID 4863454) has the molecular formula C24H24N2O4 and a molecular weight of 404.47 g/mol. Its IUPAC name is N-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide.

Molecular Properties

Compound NameN-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide
PubChem CID4863454
Molecular FormulaC24H24N2O4
Molecular Weight404.47 g/mol
Exact Mass404.17
IUPAC NameN-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide
SMILESCOc1ccccc1N(Cc1ccccc1O)C(=O)CON=C(C)c1ccccc1
InChIInChI=1S/C24H24N2O4/c1-18(19-10-4-3-5-11-19)25-30-17-24(28)26(16-20-12-6-8-14-22(20)27)21-13-7-9-15-23(21)29-2/h3-15,27H,16-17H2,1-2H3
InChIKeyVNQPNPPZRGQGQX-UHFFFAOYSA-N
XLogP4.37
TPSA71.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide?
The IUPAC name of N-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide (CID 4863454) is N-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide.
What is the SMILES notation for N-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide?
The canonical SMILES for N-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide is COc1ccccc1N(Cc1ccccc1O)C(=O)CON=C(C)c1ccccc1.
What is the InChIKey of N-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide?
The InChIKey is VNQPNPPZRGQGQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O4/c1-18(19-10-4-3-5-11-19)25-30-17-24(28)26(16-20-12-6-8-14-22(20)27)21-13-7-9-15-23(21)29-2/h3-15,27H,16-17H2,1-2H3.
What are the key properties of N-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide?
N-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide has a molecular weight of 404.47 g/mol, XLogP of 4.37, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(1-phenylethylideneamino)oxyacetamide is sourced from PubChem (CID 4863454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).