3,5-dichlorobenzohydrazide

C7H6Cl2N2O — CID 2735966

IUPAC3,5-dichlorobenzohydrazide
SMILESNNC(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C7H6Cl2N2O/c8-5-1-4(7(12)11-10)2-6(9)3-5/h1-3H,10H2,(H,11,12)
InChIKeyDNISXKBKTSHNKL-UHFFFAOYSA-N
MW205.04 g/mol
LogP1.60
Rot. Bonds1

About 3,5-dichlorobenzohydrazide

3,5-dichlorobenzohydrazide (PubChem CID 2735966) has the molecular formula C7H6Cl2N2O and a molecular weight of 205.04 g/mol. Its IUPAC name is 3,5-dichlorobenzohydrazide.

Molecular Properties

Compound Name3,5-dichlorobenzohydrazide
PubChem CID2735966
Molecular FormulaC7H6Cl2N2O
Molecular Weight205.04 g/mol
Exact Mass203.99
IUPAC Name3,5-dichlorobenzohydrazide
SMILESNNC(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C7H6Cl2N2O/c8-5-1-4(7(12)11-10)2-6(9)3-5/h1-3H,10H2,(H,11,12)
InChIKeyDNISXKBKTSHNKL-UHFFFAOYSA-N
XLogP1.60
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.04
LogP ≤ 51.60
H-Bond Donors ≤ 52
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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Related Compounds

4-bromo-3,5-dichlorobenzohydrazide
CID 169499880
3-chlorobenzohydrazide;bis(formonitrile)
CID 175536479
3,5-dichloro-N-propylbenzamide
CID 2767298
ethyl 3-[(3,5-dichlorobenzoyl)amino]propanoate
CID 47437680
3,5-dichloro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]benzamide
CID 79252918
N-(3-aminobutyl)-3,5-dichlorobenzamide
CID 63253948
N-(1-bromo-3-methylbutan-2-yl)-3,5-dichlorobenzamide
CID 114316290
N-(carbamoylcarbamothioyl)-3,5-dichlorobenzamide
CID 150538307
3,5-dichloro-N-(4-chlorophenyl)benzamide
CID 3382216
5-(hydroxymethyl)benzene-1,3-dicarbohydrazide
CID 69302191
N-(3-amino-2-methylpropyl)-3,5-dichlorobenzamide;hydrochloride
CID 119996487
3,5-dichloro-N-(1-hydroxy-4-methylpentan-3-yl)benzamide
CID 113254978

Frequently Asked Questions

What is the IUPAC name of 3,5-dichlorobenzohydrazide?
The IUPAC name of 3,5-dichlorobenzohydrazide (CID 2735966) is 3,5-dichlorobenzohydrazide.
What is the SMILES notation for 3,5-dichlorobenzohydrazide?
The canonical SMILES for 3,5-dichlorobenzohydrazide is NNC(=O)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichlorobenzohydrazide?
The InChIKey is DNISXKBKTSHNKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6Cl2N2O/c8-5-1-4(7(12)11-10)2-6(9)3-5/h1-3H,10H2,(H,11,12).
What are the key properties of 3,5-dichlorobenzohydrazide?
3,5-dichlorobenzohydrazide has a molecular weight of 205.04 g/mol, XLogP of 1.60, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichlorobenzohydrazide is sourced from PubChem (CID 2735966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).