5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide

C₁₈H₁₉ClN₂O₄ — CID 24636073

About 5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide

5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide (PubChem CID 24636073) has the molecular formula C₁₈H₁₉ClN₂O₄ and a molecular weight of 362.81 g/mol. Its IUPAC name is 5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide.

Molecular Properties

• Compound Name: 5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide
• PubChem CID: 24636073
• Molecular Formula: C₁₈H₁₉ClN₂O₄
• Molecular Weight: 362.81 g/mol
• Exact Mass: 362.10
• IUPAC Name: 5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide
• SMILES: COc1ccc(Cl)cc1C(=O)NNC(=O)COc1ccc(C)cc1C
• InChI: InChI=1S/C18H19ClN2O4/c1-11-4-6-15(12(2)8-11)25-10-17(22)20-21-18(23)14-9-13(19)5-7-16(14)24-3/h4-9H,10H2,1-3H3,(H,20,22)(H,21,23)
• InChIKey: OVVWAEUMPXWDBU-UHFFFAOYSA-N
• XLogP: 2.81
• TPSA: 76.66 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	362.81
LogP ≤ 5	2.81
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide?

The IUPAC name of 5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide (CID 24636073) is 5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide.

What is the SMILES notation for 5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide?

The canonical SMILES for 5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide is COc1ccc(Cl)cc1C(=O)NNC(=O)COc1ccc(C)cc1C.

What is the InChIKey of 5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide?

The InChIKey is OVVWAEUMPXWDBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O4/c1-11-4-6-15(12(2)8-11)25-10-17(22)20-21-18(23)14-9-13(19)5-7-16(14)24-3/h4-9H,10H2,1-3H3,(H,20,22)(H,21,23).

What are the key properties of 5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide?

5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide has a molecular weight of 362.81 g/mol, XLogP of 2.81, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide is sourced from PubChem (CID 24636073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 24636073 — identifiers, structure, computed properties (public domain)

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