N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide

C16H16N2O4 — CID 143033643

IUPACN-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide
SMILESCC(=NNC(=O)Cc1cccc(O)c1)c1ccc(O)cc1O
InChIInChI=1S/C16H16N2O4/c1-10(14-6-5-13(20)9-15(14)21)17-18-16(22)8-11-3-2-4-12(19)7-11/h2-7,9,19-21H,8H2,1H3,(H,18,22)
InChIKeyOOZHOLHHUVWWIH-UHFFFAOYSA-N
MW300.31 g/mol
LogP1.89
Rot. Bonds4

About N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide

N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide (PubChem CID 143033643) has the molecular formula C16H16N2O4 and a molecular weight of 300.31 g/mol. Its IUPAC name is N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide
PubChem CID143033643
Molecular FormulaC16H16N2O4
Molecular Weight300.31 g/mol
Exact Mass300.11
IUPAC NameN-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide
SMILESCC(=NNC(=O)Cc1cccc(O)c1)c1ccc(O)cc1O
InChIInChI=1S/C16H16N2O4/c1-10(14-6-5-13(20)9-15(14)21)17-18-16(22)8-11-3-2-4-12(19)7-11/h2-7,9,19-21H,8H2,1H3,(H,18,22)
InChIKeyOOZHOLHHUVWWIH-UHFFFAOYSA-N
XLogP1.89
TPSA102.15 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.31
LogP ≤ 51.89
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

2-(3-hydroxyphenyl)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]acetamide
CID 135734295
N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]-2-naphthalen-1-ylacetamide
CID 137166775
2-(2-benzylphenoxy)-N-[(E)-1-(2,4-dihydroxyphenyl)ethylideneamino]acetamide
CID 135576128
N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]nonanamide
CID 136717836
N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide
CID 4124156
N-[(E)-1-(2,4-dihydroxyphenyl)ethylideneamino]furan-2-carboxamide
CID 135644319
N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-hydroxybenzamide
CID 708171
N-[(E)-1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 135811310
2-chloro-N-[2-[(2E)-2-[1-(2,4-dihydroxyphenyl)ethylidene]hydrazinyl]-2-oxoethyl]benzamide
CID 135648810
N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(4-iodoanilino)acetamide
CID 137140814
1-[(E)-1-(2,4-dihydroxyphenyl)ethylideneamino]-3-phenylurea
CID 135643114
N-[(E)-1-(2,4-dihydroxyphenyl)ethylideneamino]-2-quinolin-8-ylsulfanylacetamide
CID 135673668

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide?
The IUPAC name of N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide (CID 143033643) is N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide.
What is the SMILES notation for N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide?
The canonical SMILES for N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide is CC(=NNC(=O)Cc1cccc(O)c1)c1ccc(O)cc1O.
What is the InChIKey of N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide?
The InChIKey is OOZHOLHHUVWWIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O4/c1-10(14-6-5-13(20)9-15(14)21)17-18-16(22)8-11-3-2-4-12(19)7-11/h2-7,9,19-21H,8H2,1H3,(H,18,22).
What are the key properties of N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide?
N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide has a molecular weight of 300.31 g/mol, XLogP of 1.89, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide is sourced from PubChem (CID 143033643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).