2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide

C16H14Cl2N2O2 — CID 26163582

IUPAC2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide
SMILESCc1ccccc1CC(=O)NNC(=O)c1ccc(Cl)cc1Cl
InChIInChI=1S/C16H14Cl2N2O2/c1-10-4-2-3-5-11(10)8-15(21)19-20-16(22)13-7-6-12(17)9-14(13)18/h2-7,9H,8H2,1H3,(H,19,21)(H,20,22)
InChIKeyWWLTZNARMCUYJR-UHFFFAOYSA-N
MW337.21 g/mol
LogP3.31
Rot. Bonds3

About 2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide

2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide (PubChem CID 26163582) has the molecular formula C16H14Cl2N2O2 and a molecular weight of 337.21 g/mol. Its IUPAC name is 2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide.

Molecular Properties

Compound Name2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide
PubChem CID26163582
Molecular FormulaC16H14Cl2N2O2
Molecular Weight337.21 g/mol
Exact Mass336.04
IUPAC Name2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide
SMILESCc1ccccc1CC(=O)NNC(=O)c1ccc(Cl)cc1Cl
InChIInChI=1S/C16H14Cl2N2O2/c1-10-4-2-3-5-11(10)8-15(21)19-20-16(22)13-7-6-12(17)9-14(13)18/h2-7,9H,8H2,1H3,(H,19,21)(H,20,22)
InChIKeyWWLTZNARMCUYJR-UHFFFAOYSA-N
XLogP3.31
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.21
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide?
The IUPAC name of 2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide (CID 26163582) is 2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide.
What is the SMILES notation for 2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide?
The canonical SMILES for 2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide is Cc1ccccc1CC(=O)NNC(=O)c1ccc(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide?
The InChIKey is WWLTZNARMCUYJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N2O2/c1-10-4-2-3-5-11(10)8-15(21)19-20-16(22)13-7-6-12(17)9-14(13)18/h2-7,9H,8H2,1H3,(H,19,21)(H,20,22).
What are the key properties of 2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide?
2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide has a molecular weight of 337.21 g/mol, XLogP of 3.31, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N'-[2-(2-methylphenyl)acetyl]benzohydrazide is sourced from PubChem (CID 26163582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).