4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide

C16H14Cl2N2O3 — CID 5182764

IUPAC4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide
SMILESCc1cc(Cl)ccc1OCC(=O)NNC(=O)c1ccc(Cl)cc1
InChIInChI=1S/C16H14Cl2N2O3/c1-10-8-13(18)6-7-14(10)23-9-15(21)19-20-16(22)11-2-4-12(17)5-3-11/h2-8H,9H2,1H3,(H,19,21)(H,20,22)
InChIKeyRRIHNFHVXSUQLQ-UHFFFAOYSA-N
MW353.21 g/mol
LogP3.14
Rot. Bonds4

About 4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide

4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide (PubChem CID 5182764) has the molecular formula C16H14Cl2N2O3 and a molecular weight of 353.21 g/mol. Its IUPAC name is 4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide.

Molecular Properties

Compound Name4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide
PubChem CID5182764
Molecular FormulaC16H14Cl2N2O3
Molecular Weight353.21 g/mol
Exact Mass352.04
IUPAC Name4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide
SMILESCc1cc(Cl)ccc1OCC(=O)NNC(=O)c1ccc(Cl)cc1
InChIInChI=1S/C16H14Cl2N2O3/c1-10-8-13(18)6-7-14(10)23-9-15(21)19-20-16(22)11-2-4-12(17)5-3-11/h2-8H,9H2,1H3,(H,19,21)(H,20,22)
InChIKeyRRIHNFHVXSUQLQ-UHFFFAOYSA-N
XLogP3.14
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.21
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]pyridine-3-carbohydrazide
CID 78771863
N'-[2-(4-chloro-2-methylphenoxy)acetyl]-2-(4-chlorophenoxy)acetohydrazide
CID 5186778
N'-[2-(4-chloro-2-methylphenoxy)acetyl]-4-hexoxybenzohydrazide
CID 4930734
5,6-dichloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]pyridine-3-carbohydrazide
CID 7943823
N'-[2-(4-chloro-2-methylphenoxy)acetyl]-3-ethoxybenzohydrazide
CID 4957534
N'-[2-(4-chloro-2-methylphenoxy)acetyl]butanehydrazide
CID 3250924
methyl 4-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamoyl]benzoate
CID 17178356
N'-[2-(4-chloro-2-methylphenoxy)acetyl]furan-2-carbohydrazide
CID 2273531
2-(4-chloro-2-methylphenoxy)-N'-[2-(2-methoxyphenoxy)acetyl]acetohydrazide
CID 2545386
4-tert-butyl-N'-[2-(2,4-dimethylphenoxy)acetyl]benzohydrazide
CID 4500599
4-bromo-N'-[2-(2-bromo-4-chlorophenoxy)acetyl]benzohydrazide
CID 54790834
5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide
CID 24636073

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide?
The IUPAC name of 4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide (CID 5182764) is 4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide.
What is the SMILES notation for 4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide?
The canonical SMILES for 4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide is Cc1cc(Cl)ccc1OCC(=O)NNC(=O)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide?
The InChIKey is RRIHNFHVXSUQLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N2O3/c1-10-8-13(18)6-7-14(10)23-9-15(21)19-20-16(22)11-2-4-12(17)5-3-11/h2-8H,9H2,1H3,(H,19,21)(H,20,22).
What are the key properties of 4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide?
4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide has a molecular weight of 353.21 g/mol, XLogP of 3.14, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide is sourced from PubChem (CID 5182764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).