(2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone

C20H15ClN2O — CID 6172850

IUPAC(2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone
SMILESO=C(/C(=N\Nc1cccc(Cl)c1)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H15ClN2O/c21-17-12-7-13-18(14-17)22-23-19(15-8-3-1-4-9-15)20(24)16-10-5-2-6-11-16/h1-14,22H/b23-19-
InChIKeyUYRPUIKKHDQVIZ-NMWGTECJSA-N
MW334.81 g/mol
LogP5.04
Rot. Bonds5

About (2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone

(2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone (PubChem CID 6172850) has the molecular formula C20H15ClN2O and a molecular weight of 334.81 g/mol. Its IUPAC name is (2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone.

Molecular Properties

Compound Name(2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone
PubChem CID6172850
Molecular FormulaC20H15ClN2O
Molecular Weight334.81 g/mol
Exact Mass334.09
IUPAC Name(2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone
SMILESO=C(/C(=N\Nc1cccc(Cl)c1)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H15ClN2O/c21-17-12-7-13-18(14-17)22-23-19(15-8-3-1-4-9-15)20(24)16-10-5-2-6-11-16/h1-14,22H/b23-19-
InChIKeyUYRPUIKKHDQVIZ-NMWGTECJSA-N
XLogP5.04
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.81
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[(3-chloro-4-methylphenyl)hydrazinylidene]-1,2-diphenylethanone
CID 3415921
3-chloro-N-[[phenyl(pyridin-4-yl)methylidene]amino]aniline
CID 4224641
(1Z)-2-(3-chloroanilino)-N-(3-chlorophenyl)-2-oxoethanehydrazonoyl chloride
CID 10882442
2-(3-chloroanilino)-1-oxoguanidine
CID 46183330
2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone
CID 154386910
2-(3-chloroanilino)-1,3-diphenylpropane-1,3-dione
CID 123487664
(2Z)-N-methyl-2-phenyl-2-(phenylhydrazinylidene)acetamide
CID 15371306
2-[(3-chlorophenyl)hydrazinylidene]propanedinitrile
CID 2603
N-(3-chlorophenyl)-N'-(1-phenylethylideneamino)oxamide
CID 4249349
N-(3-chlorophenyl)acetamide;N-phenylacetamide
CID 160915382
(2Z)-2-(4-chlorophenyl)-2-hydroxyimino-1-phenylethanone
CID 6415852
3-[(2E)-2-[1-(2,5-dichlorophenyl)ethylidene]hydrazinyl]benzoic acid
CID 16555836

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone?
The IUPAC name of (2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone (CID 6172850) is (2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone.
What is the SMILES notation for (2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone?
The canonical SMILES for (2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone is O=C(/C(=N\Nc1cccc(Cl)c1)c1ccccc1)c1ccccc1.
What is the InChIKey of (2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone?
The InChIKey is UYRPUIKKHDQVIZ-NMWGTECJSA-N. The full InChI is InChI=1S/C20H15ClN2O/c21-17-12-7-13-18(14-17)22-23-19(15-8-3-1-4-9-15)20(24)16-10-5-2-6-11-16/h1-14,22H/b23-19-.
What are the key properties of (2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone?
(2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone has a molecular weight of 334.81 g/mol, XLogP of 5.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone is sourced from PubChem (CID 6172850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).