2-(diphenylhydrazinylidene)-1,2-diphenylethanone

C26H20N2O — CID 569987

IUPAC2-(diphenylhydrazinylidene)-1,2-diphenylethanone
SMILESO=C(C(=NN(c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C26H20N2O/c29-26(22-15-7-2-8-16-22)25(21-13-5-1-6-14-21)27-28(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
InChIKeyQRVXSYMWVDFTQT-UHFFFAOYSA-N
MW376.46 g/mol
LogP6.11
Rot. Bonds6

About 2-(diphenylhydrazinylidene)-1,2-diphenylethanone

2-(diphenylhydrazinylidene)-1,2-diphenylethanone (PubChem CID 569987) has the molecular formula C26H20N2O and a molecular weight of 376.46 g/mol. Its IUPAC name is 2-(diphenylhydrazinylidene)-1,2-diphenylethanone.

Molecular Properties

Compound Name2-(diphenylhydrazinylidene)-1,2-diphenylethanone
PubChem CID569987
Molecular FormulaC26H20N2O
Molecular Weight376.46 g/mol
Exact Mass376.16
IUPAC Name2-(diphenylhydrazinylidene)-1,2-diphenylethanone
SMILESO=C(C(=NN(c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C26H20N2O/c29-26(22-15-7-2-8-16-22)25(21-13-5-1-6-14-21)27-28(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
InChIKeyQRVXSYMWVDFTQT-UHFFFAOYSA-N
XLogP6.11
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.46
LogP ≤ 56.11
H-Bond Donors ≤ 50
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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Frequently Asked Questions

What is the IUPAC name of 2-(diphenylhydrazinylidene)-1,2-diphenylethanone?
The IUPAC name of 2-(diphenylhydrazinylidene)-1,2-diphenylethanone (CID 569987) is 2-(diphenylhydrazinylidene)-1,2-diphenylethanone.
What is the SMILES notation for 2-(diphenylhydrazinylidene)-1,2-diphenylethanone?
The canonical SMILES for 2-(diphenylhydrazinylidene)-1,2-diphenylethanone is O=C(C(=NN(c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(diphenylhydrazinylidene)-1,2-diphenylethanone?
The InChIKey is QRVXSYMWVDFTQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N2O/c29-26(22-15-7-2-8-16-22)25(21-13-5-1-6-14-21)27-28(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H.
What are the key properties of 2-(diphenylhydrazinylidene)-1,2-diphenylethanone?
2-(diphenylhydrazinylidene)-1,2-diphenylethanone has a molecular weight of 376.46 g/mol, XLogP of 6.11, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diphenylhydrazinylidene)-1,2-diphenylethanone is sourced from PubChem (CID 569987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).