2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide

C18H18N2O2 — CID 6273819

IUPAC2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide
SMILESCC(/C=C/c1ccccc1)=N/NC(=O)C(O)c1ccccc1
InChIInChI=1S/C18H18N2O2/c1-14(12-13-15-8-4-2-5-9-15)19-20-18(22)17(21)16-10-6-3-7-11-16/h2-13,17,21H,1H3,(H,20,22)/b13-12+,19-14-
InChIKeyJXDVRGMQJDBIDW-OZGAEJQKSA-N
MW294.35 g/mol
LogP2.93
Rot. Bonds5

About 2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide

2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide (PubChem CID 6273819) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is 2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide.

Molecular Properties

Compound Name2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide
PubChem CID6273819
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide
SMILESCC(/C=C/c1ccccc1)=N/NC(=O)C(O)c1ccccc1
InChIInChI=1S/C18H18N2O2/c1-14(12-13-15-8-4-2-5-9-15)19-20-18(22)17(21)16-10-6-3-7-11-16/h2-13,17,21H,1H3,(H,20,22)/b13-12+,19-14-
InChIKeyJXDVRGMQJDBIDW-OZGAEJQKSA-N
XLogP2.93
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-Hydroxy-2-phenylacetohydrazide
CID 73126
N'-(2-hydroxy-1,2-diphenylethylidene)acetohydrazide
CID 5331368
2-hydroxy-2-phenyl-N-[(Z)-[(3E,5E)-6-phenylhexa-3,5-dien-2-ylidene]amino]acetamide
CID 5722582
Methoxy-phenyl-acetic acid [1-(4-tert-butyl-phenyl)-ethylidene]-hydrazide
CID 9592925
N'-(1-benzyl-4-piperidinylidene)-2-hydroxy-2-phenylacetohydrazide
CID 4646737
Hydroxy-phenyl-acetic acid benzylidene-hydrazide
CID 5335263
Methoxy-phenyl-acetic acid (1-p-tolyl-ethylidene)-hydrazide
CID 5779158
N'-[(1E)-1-(4-chlorophenyl)ethylidene]-2-hydroxy-2-phenylacetohydrazide
CID 9592800
Methoxy-phenyl-acetic acid [1-(4-hydroxy-phenyl)-ethylidene]-hydrazide
CID 135537541
2-hydroxy-2-phenyl-N'-(3-phenyl-2-propen-1-ylidene)acetohydrazide
CID 5334899
N'-[(1E,2Z)-2-bromo-3-phenylprop-2-en-1-ylidene]-2-hydroxy-2-phenylacetohydrazide
CID 5340398
2-hydroxy-N'-[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-2-phenylacetohydrazide
CID 9586036

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide?
The IUPAC name of 2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide (CID 6273819) is 2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide.
What is the SMILES notation for 2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide?
The canonical SMILES for 2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide is CC(/C=C/c1ccccc1)=N/NC(=O)C(O)c1ccccc1.
What is the InChIKey of 2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide?
The InChIKey is JXDVRGMQJDBIDW-OZGAEJQKSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-14(12-13-15-8-4-2-5-9-15)19-20-18(22)17(21)16-10-6-3-7-11-16/h2-13,17,21H,1H3,(H,20,22)/b13-12+,19-14-.
What are the key properties of 2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide?
2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide has a molecular weight of 294.35 g/mol, XLogP of 2.93, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-phenyl-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide is sourced from PubChem (CID 6273819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).