(2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide

C12H12ClNO2 — CID 11687325

IUPAC(2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide
SMILESCC(/C=C/C(=O)NO)=C\c1ccc(Cl)cc1
InChIInChI=1S/C12H12ClNO2/c1-9(2-7-12(15)14-16)8-10-3-5-11(13)6-4-10/h2-8,16H,1H3,(H,14,15)/b7-2+,9-8+
InChIKeyQTJGIAKMPQMBBB-BRTFRICFSA-N
MW237.69 g/mol
LogP2.80
Rot. Bonds3

About (2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide

(2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide (PubChem CID 11687325) has the molecular formula C12H12ClNO2 and a molecular weight of 237.69 g/mol. Its IUPAC name is (2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide.

Molecular Properties

Compound Name(2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide
PubChem CID11687325
Molecular FormulaC12H12ClNO2
Molecular Weight237.69 g/mol
Exact Mass237.06
IUPAC Name(2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide
SMILESCC(/C=C/C(=O)NO)=C\c1ccc(Cl)cc1
InChIInChI=1S/C12H12ClNO2/c1-9(2-7-12(15)14-16)8-10-3-5-11(13)6-4-10/h2-8,16H,1H3,(H,14,15)/b7-2+,9-8+
InChIKeyQTJGIAKMPQMBBB-BRTFRICFSA-N
XLogP2.80
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.69
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze (2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide?
The IUPAC name of (2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide (CID 11687325) is (2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide.
What is the SMILES notation for (2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide?
The canonical SMILES for (2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide is CC(/C=C/C(=O)NO)=C\c1ccc(Cl)cc1.
What is the InChIKey of (2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide?
The InChIKey is QTJGIAKMPQMBBB-BRTFRICFSA-N. The full InChI is InChI=1S/C12H12ClNO2/c1-9(2-7-12(15)14-16)8-10-3-5-11(13)6-4-10/h2-8,16H,1H3,(H,14,15)/b7-2+,9-8+.
What are the key properties of (2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide?
(2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide has a molecular weight of 237.69 g/mol, XLogP of 2.80, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E)-5-(4-chlorophenyl)-N-hydroxy-4-methylpenta-2,4-dienamide is sourced from PubChem (CID 11687325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).