2-(2,4-dichlorophenyl)-N-methylacetohydrazide

C9H10Cl2N2O — CID 116844869

IUPAC2-(2,4-dichlorophenyl)-N-methylacetohydrazide
SMILESCN(N)C(=O)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C9H10Cl2N2O/c1-13(12)9(14)4-6-2-3-7(10)5-8(6)11/h2-3,5H,4,12H2,1H3
InChIKeyCWVZOCWLWXSPGF-UHFFFAOYSA-N
MW233.10 g/mol
LogP1.87
Rot. Bonds2

About 2-(2,4-dichlorophenyl)-N-methylacetohydrazide

2-(2,4-dichlorophenyl)-N-methylacetohydrazide (PubChem CID 116844869) has the molecular formula C9H10Cl2N2O and a molecular weight of 233.10 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-N-methylacetohydrazide.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-N-methylacetohydrazide
PubChem CID116844869
Molecular FormulaC9H10Cl2N2O
Molecular Weight233.10 g/mol
Exact Mass232.02
IUPAC Name2-(2,4-dichlorophenyl)-N-methylacetohydrazide
SMILESCN(N)C(=O)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C9H10Cl2N2O/c1-13(12)9(14)4-6-2-3-7(10)5-8(6)11/h2-3,5H,4,12H2,1H3
InChIKeyCWVZOCWLWXSPGF-UHFFFAOYSA-N
XLogP1.87
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.10
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-N-methylacetohydrazide?
The IUPAC name of 2-(2,4-dichlorophenyl)-N-methylacetohydrazide (CID 116844869) is 2-(2,4-dichlorophenyl)-N-methylacetohydrazide.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-N-methylacetohydrazide?
The canonical SMILES for 2-(2,4-dichlorophenyl)-N-methylacetohydrazide is CN(N)C(=O)Cc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenyl)-N-methylacetohydrazide?
The InChIKey is CWVZOCWLWXSPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10Cl2N2O/c1-13(12)9(14)4-6-2-3-7(10)5-8(6)11/h2-3,5H,4,12H2,1H3.
What are the key properties of 2-(2,4-dichlorophenyl)-N-methylacetohydrazide?
2-(2,4-dichlorophenyl)-N-methylacetohydrazide has a molecular weight of 233.10 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-N-methylacetohydrazide is sourced from PubChem (CID 116844869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).