2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone

C14H11ClN2O — CID 154386910

IUPAC2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone
SMILESNN=C(C(=O)c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C14H11ClN2O/c15-12-8-6-10(7-9-12)13(17-16)14(18)11-4-2-1-3-5-11/h1-9H,16H2
InChIKeyNXWSFFYJHLHYSQ-UHFFFAOYSA-N
MW258.71 g/mol
LogP2.89
Rot. Bonds3

About 2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone

2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone (PubChem CID 154386910) has the molecular formula C14H11ClN2O and a molecular weight of 258.71 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone.

Molecular Properties

Compound Name2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone
PubChem CID154386910
Molecular FormulaC14H11ClN2O
Molecular Weight258.71 g/mol
Exact Mass258.06
IUPAC Name2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone
SMILESNN=C(C(=O)c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C14H11ClN2O/c15-12-8-6-10(7-9-12)13(17-16)14(18)11-4-2-1-3-5-11/h1-9H,16H2
InChIKeyNXWSFFYJHLHYSQ-UHFFFAOYSA-N
XLogP2.89
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.71
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', '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

1-(4-aminophenyl)-2-hydrazinylidene-2-phenylethanone
CID 173282909
(2Z)-2-(4-chlorophenyl)-2-hydroxyimino-1-phenylethanone
CID 6415852
(2Z)-2-hydrazinylidene-2-(4-nitrophenyl)-1-phenylethanone
CID 27138490
[4-[2-(4-methoxyphenyl)-2-oxoethanehydrazonoyl]phenyl] benzoate
CID 22300297
(1E)-2-oxo-2-phenylethanehydrazonoyl chloride
CID 45080811
(4-chlorophenyl)-phenylmethanone dichloride
CID 22505815
(2E)-2-hydrazinylidene-1,2-bis[4-(trifluoromethyl)phenyl]ethanone
CID 11696179
(Z)-2-(4-chlorophenyl)-3-hydroxy-1-phenylprop-2-en-1-one
CID 11817774
bis(1,2-diphenylethane-1,2-dione);hydrogen peroxide
CID 18415505
(2Z)-2-[(3-chlorophenyl)hydrazinylidene]-1,2-diphenylethanone
CID 6172850
(4-chlorophenyl)-phenylmethanone;propan-2-one
CID 175521712
3-amino-2-benzoyl-3-(4-chlorophenyl)prop-2-enenitrile
CID 131844104

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone?
The IUPAC name of 2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone (CID 154386910) is 2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone.
What is the SMILES notation for 2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone?
The canonical SMILES for 2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone is NN=C(C(=O)c1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone?
The InChIKey is NXWSFFYJHLHYSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2O/c15-12-8-6-10(7-9-12)13(17-16)14(18)11-4-2-1-3-5-11/h1-9H,16H2.
What are the key properties of 2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone?
2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone has a molecular weight of 258.71 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-2-hydrazinylidene-1-phenylethanone is sourced from PubChem (CID 154386910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).