N-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide

C17H17N3O3 — CID 135583641

IUPACN-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide
SMILESCCc1ccc(NC(=O)C(=O)N/N=C/c2ccc(O)cc2)cc1
InChIInChI=1S/C17H17N3O3/c1-2-12-3-7-14(8-4-12)19-16(22)17(23)20-18-11-13-5-9-15(21)10-6-13/h3-11,21H,2H2,1H3,(H,19,22)(H,20,23)/b18-11+
InChIKeyFVLKTOBLZDJSQP-WOJGMQOQSA-N
MW311.34 g/mol
LogP2.04
Rot. Bonds4

About N-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide

N-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide (PubChem CID 135583641) has the molecular formula C17H17N3O3 and a molecular weight of 311.34 g/mol. Its IUPAC name is N-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide
PubChem CID135583641
Molecular FormulaC17H17N3O3
Molecular Weight311.34 g/mol
Exact Mass311.13
IUPAC NameN-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide
SMILESCCc1ccc(NC(=O)C(=O)N/N=C/c2ccc(O)cc2)cc1
InChIInChI=1S/C17H17N3O3/c1-2-12-3-7-14(8-4-12)19-16(22)17(23)20-18-11-13-5-9-15(21)10-6-13/h3-11,21H,2H2,1H3,(H,19,22)(H,20,23)/b18-11+
InChIKeyFVLKTOBLZDJSQP-WOJGMQOQSA-N
XLogP2.04
TPSA90.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 52.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Gsk-9089
CID 5497124
2-(2-(3-Allyl-2-hydroxybenzylidene)hydrazino)-N-(4-methylphenyl)-2-oxoacetamide
CID 135433321
N-[[4-(diethylamino)phenyl]methylideneamino]-4-hydroxybenzamide
CID 644030
N'-[(1E)-(5-hydroxy-2-nitrophenyl)methylene]-2-[(4-methylphenyl)amino]acetohydrazide
CID 9557028
N-[(1E)-2-(2-hydroxyphenyl)-1-azaprop-1-enyl]-2-[(methylsulfonyl)phenylamino]a cetamide
CID 135519931
4-[(2E)-2-(2,4-dihydroxybenzylidene)hydrazino]-N-(4-methylphenyl)-4-oxobutanamide
CID 135620064
4-[(2E)-2-(2-hydroxybenzylidene)hydrazino]-N-(4-methylphenyl)-4-oxobutanamide
CID 135683576
N-(4-Fluorophenyl)-3-{N'-[(E)-(4-hydroxyphenyl)methylidene]hydrazinecarbonyl}propanamide
CID 135625972
2-[(2E)-2-(2-hydroxybenzylidene)hydrazinyl]-N-(2-methylphenyl)-2-oxoacetamide
CID 135419636
L-Tyrosine, [[4-[bis(2-chloroethyl)amino]phenyl]methylene]hydrazide
CID 256179
N'-(3-allyl-2-hydroxybenzylidene)-2-(4-toluidino)propanohydrazide
CID 135401434
N'-(3-allyl-2-hydroxybenzylidene)-4-[(4-methylphenyl)amino]butanohydrazide
CID 135425036

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide?
The IUPAC name of N-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide (CID 135583641) is N-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide.
What is the SMILES notation for N-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide?
The canonical SMILES for N-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide is CCc1ccc(NC(=O)C(=O)N/N=C/c2ccc(O)cc2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide?
The InChIKey is FVLKTOBLZDJSQP-WOJGMQOQSA-N. The full InChI is InChI=1S/C17H17N3O3/c1-2-12-3-7-14(8-4-12)19-16(22)17(23)20-18-11-13-5-9-15(21)10-6-13/h3-11,21H,2H2,1H3,(H,19,22)(H,20,23)/b18-11+.
What are the key properties of N-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide?
N-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide has a molecular weight of 311.34 g/mol, XLogP of 2.04, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide is sourced from PubChem (CID 135583641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).