4,4-diphenylbut-3-en-2-one;hydrazine

C16H18N2O — CID 158754130

IUPAC4,4-diphenylbut-3-en-2-one;hydrazine
SMILESCC(=O)C=C(c1ccccc1)c1ccccc1.NN
InChIInChI=1S/C16H14O.H4N2/c1-13(17)12-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15;1-2/h2-12H,1H3;1-2H2
InChIKeyINVSLPHYHVZCQL-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.53
Rot. Bonds3

About 4,4-diphenylbut-3-en-2-one;hydrazine

4,4-diphenylbut-3-en-2-one;hydrazine (PubChem CID 158754130) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 4,4-diphenylbut-3-en-2-one;hydrazine.

Molecular Properties

Compound Name4,4-diphenylbut-3-en-2-one;hydrazine
PubChem CID158754130
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name4,4-diphenylbut-3-en-2-one;hydrazine
SMILESCC(=O)C=C(c1ccccc1)c1ccccc1.NN
InChIInChI=1S/C16H14O.H4N2/c1-13(17)12-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15;1-2/h2-12H,1H3;1-2H2
InChIKeyINVSLPHYHVZCQL-UHFFFAOYSA-N
XLogP2.53
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4,4-diphenylbut-3-en-2-one;ethane;propan-2-one
CID 91332557
4-phenylpent-3-en-2-one
CID 594380
ethane;4-phenylpent-3-en-2-one
CID 123324566
[(Z)-3-oxo-1-phenylbut-1-enyl]oxidanium
CID 6390563
gallium tris(3-oxo-1-phenylbut-1-en-1-olate)
CID 73160345
5-bromo-4-phenylpent-3-en-2-one
CID 54089835
sodium (Z)-3-oxo-1-phenylbut-1-en-1-olate
CID 23681715
4-hydroxy-4-[4-(1,2,2-triphenylethenyl)phenyl]but-3-en-2-one
CID 175049722
(3Z)-5-methyl-4-phenylhexa-3,5-dien-2-one
CID 145260514
bis(iron(2+));(Z)-4-oxopent-2-en-2-olate;benzoate
CID 23332500
4-oxo-2-phenylpent-2-enenitrile
CID 91279412
(Z)-4-nitro-4-phenylbut-3-en-2-one
CID 6439839

Frequently Asked Questions

What is the IUPAC name of 4,4-diphenylbut-3-en-2-one;hydrazine?
The IUPAC name of 4,4-diphenylbut-3-en-2-one;hydrazine (CID 158754130) is 4,4-diphenylbut-3-en-2-one;hydrazine.
What is the SMILES notation for 4,4-diphenylbut-3-en-2-one;hydrazine?
The canonical SMILES for 4,4-diphenylbut-3-en-2-one;hydrazine is CC(=O)C=C(c1ccccc1)c1ccccc1.NN.
What is the InChIKey of 4,4-diphenylbut-3-en-2-one;hydrazine?
The InChIKey is INVSLPHYHVZCQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14O.H4N2/c1-13(17)12-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15;1-2/h2-12H,1H3;1-2H2.
What are the key properties of 4,4-diphenylbut-3-en-2-one;hydrazine?
4,4-diphenylbut-3-en-2-one;hydrazine has a molecular weight of 254.33 g/mol, XLogP of 2.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-diphenylbut-3-en-2-one;hydrazine is sourced from PubChem (CID 158754130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).