2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide

C17H18N2O2 — CID 126364736

IUPAC2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide
SMILESCc1ccc(C)c(CC(=O)N/N=C\c2cccc(O)c2)c1
InChIInChI=1S/C17H18N2O2/c1-12-6-7-13(2)15(8-12)10-17(21)19-18-11-14-4-3-5-16(20)9-14/h3-9,11,20H,10H2,1-2H3,(H,19,21)/b18-11-
InChIKeyBRWIIDMGJAPWIF-WQRHYEAKSA-N
MW282.34 g/mol
LogP2.70
Rot. Bonds4

About 2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide

2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide (PubChem CID 126364736) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide
PubChem CID126364736
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide
SMILESCc1ccc(C)c(CC(=O)N/N=C\c2cccc(O)c2)c1
InChIInChI=1S/C17H18N2O2/c1-12-6-7-13(2)15(8-12)10-17(21)19-18-11-14-4-3-5-16(20)9-14/h3-9,11,20H,10H2,1-2H3,(H,19,21)/b18-11-
InChIKeyBRWIIDMGJAPWIF-WQRHYEAKSA-N
XLogP2.70
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide 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

2-(2,5-dimethylphenoxy)-N-[(E)-(3-hydroxyphenyl)methylideneamino]acetamide
CID 6911005
N'-[(3-hydroxyphenyl)methylideneamino]-N-(4-methylphenyl)butanediamide
CID 5041906
2-(2,4-dimethylphenyl)-N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide
CID 92657855
2-(2,4-dimethylphenyl)-N-[(E)-(3-iodophenyl)methylideneamino]acetamide
CID 99944759
N-[(E)-(3-chlorophenyl)methylideneamino]-2-(2,4-dimethylphenyl)acetamide
CID 133143775
N-[(E)-benzylideneamino]-2-(2,4-dimethylphenyl)acetamide
CID 133143773
N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-2-(2,5-dimethylphenyl)acetamide
CID 126370340
2-(2,4-dimethylphenyl)-N-[(Z)-(3-propan-2-yloxyphenyl)methylideneamino]acetamide
CID 92657857
N'-[(3-hydroxyphenyl)methylideneamino]-N-(2-methylphenyl)propanediamide
CID 5024067
N-[(E)-(3-hydroxyphenyl)methylideneamino]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
CID 6898722
ethyl N-[(E)-(3-hydroxyphenyl)methylideneamino]carbamate
CID 6861610
2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)acetamide
CID 55087243

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide?
The IUPAC name of 2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide (CID 126364736) is 2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide?
The canonical SMILES for 2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide is Cc1ccc(C)c(CC(=O)N/N=C\c2cccc(O)c2)c1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide?
The InChIKey is BRWIIDMGJAPWIF-WQRHYEAKSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-12-6-7-13(2)15(8-12)10-17(21)19-18-11-14-4-3-5-16(20)9-14/h3-9,11,20H,10H2,1-2H3,(H,19,21)/b18-11-.
What are the key properties of 2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide?
2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide has a molecular weight of 282.34 g/mol, XLogP of 2.70, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide is sourced from PubChem (CID 126364736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).