5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide

C17H17ClN2O4 — CID 2709916

IUPAC5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide
SMILESCOc1ccc(Cl)cc1C(=O)NNC(=O)COc1ccccc1C
InChIInChI=1S/C17H17ClN2O4/c1-11-5-3-4-6-14(11)24-10-16(21)19-20-17(22)13-9-12(18)7-8-15(13)23-2/h3-9H,10H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyZPQURMGTICGACZ-UHFFFAOYSA-N
MW348.79 g/mol
LogP2.50
Rot. Bonds5

About 5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide

5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide (PubChem CID 2709916) has the molecular formula C17H17ClN2O4 and a molecular weight of 348.79 g/mol. Its IUPAC name is 5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide.

Molecular Properties

Compound Name5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide
PubChem CID2709916
Molecular FormulaC17H17ClN2O4
Molecular Weight348.79 g/mol
Exact Mass348.09
IUPAC Name5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide
SMILESCOc1ccc(Cl)cc1C(=O)NNC(=O)COc1ccccc1C
InChIInChI=1S/C17H17ClN2O4/c1-11-5-3-4-6-14(11)24-10-16(21)19-20-17(22)13-9-12(18)7-8-15(13)23-2/h3-9H,10H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyZPQURMGTICGACZ-UHFFFAOYSA-N
XLogP2.50
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.79
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide
CID 24636073
5-chloro-N'-[2-(2-ethoxyphenoxy)acetyl]-2-methoxybenzohydrazide
CID 24536002
5-chloro-2-methoxy-N'-(2-phenoxyacetyl)benzohydrazide
CID 2634898
2,4,5-trimethoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide
CID 9470051
5-chloro-N'-[2-(2-cyanophenoxy)acetyl]-2-methoxybenzohydrazide
CID 4811622
2-(4-chloro-2-methylphenoxy)-N'-[2-(2-methoxyphenoxy)acetyl]acetohydrazide
CID 2545386
5-chloro-N'-(5-chloro-2-methoxybenzoyl)-2-methoxybenzohydrazide
CID 7922079
N-[[[2-(4-chloro-2-methylphenoxy)acetyl]amino]carbamothioyl]-2-methoxybenzamide
CID 4980742
[2-[2-(5-chloro-2-methoxybenzoyl)hydrazinyl]-2-oxoethyl] (E)-3-(2-methylphenyl)prop-2-enoate
CID 7849579
5-chloro-2-methoxy-N'-[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]benzohydrazide
CID 24636112
2-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]benzohydrazide
CID 909280
5-chloro-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-hydroxybenzohydrazide
CID 55376169

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide?
The IUPAC name of 5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide (CID 2709916) is 5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide.
What is the SMILES notation for 5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide?
The canonical SMILES for 5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide is COc1ccc(Cl)cc1C(=O)NNC(=O)COc1ccccc1C.
What is the InChIKey of 5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide?
The InChIKey is ZPQURMGTICGACZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O4/c1-11-5-3-4-6-14(11)24-10-16(21)19-20-17(22)13-9-12(18)7-8-15(13)23-2/h3-9H,10H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of 5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide?
5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide has a molecular weight of 348.79 g/mol, XLogP of 2.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-methoxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide is sourced from PubChem (CID 2709916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).