3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide

C23H20N2O3 — CID 5088874

IUPAC3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide
SMILESO=C(C=Cc1ccccc1)NNC(=O)COc1ccccc1-c1ccccc1
InChIInChI=1S/C23H20N2O3/c26-22(16-15-18-9-3-1-4-10-18)24-25-23(27)17-28-21-14-8-7-13-20(21)19-11-5-2-6-12-19/h1-16H,17H2,(H,24,26)(H,25,27)
InChIKeyUZZABTFWNHZZTL-UHFFFAOYSA-N
MW372.42 g/mol
LogP3.59
Rot. Bonds6

About 3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide

3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide (PubChem CID 5088874) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is 3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide.

Molecular Properties

Compound Name3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide
PubChem CID5088874
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC Name3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide
SMILESO=C(C=Cc1ccccc1)NNC(=O)COc1ccccc1-c1ccccc1
InChIInChI=1S/C23H20N2O3/c26-22(16-15-18-9-3-1-4-10-18)24-25-23(27)17-28-21-14-8-7-13-20(21)19-11-5-2-6-12-19/h1-16H,17H2,(H,24,26)(H,25,27)
InChIKeyUZZABTFWNHZZTL-UHFFFAOYSA-N
XLogP3.59
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(E)-3-(4-nitrophenyl)-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide
CID 6182233
(E)-3-(2-bromophenyl)-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide
CID 26840564
3-naphthalen-1-yl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide
CID 5089375
(E)-N'-[2-(2-phenylphenoxy)acetyl]-3-quinoxalin-2-ylprop-2-enehydrazide
CID 26840468
(E)-N'-[2-(2,3-dimethylphenoxy)acetyl]-3-phenylprop-2-enehydrazide
CID 17343908
N'-[(E)-2-phenylethenyl]sulfonyl-2-(2-phenylphenoxy)acetohydrazide
CID 8506313
N'-acetyl-2-(2-phenylphenoxy)acetohydrazide
CID 922584
2-(2-phenylphenoxy)-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]acetamide
CID 7744227
3-(3,4-dimethoxyphenyl)-N-[[[2-(2-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide
CID 3622606
2-(2-methylphenoxy)-N'-[2-(2-phenylphenoxy)acetyl]acetohydrazide
CID 5089372
1-N',4-N'-bis[2-(2-phenylphenoxy)acetyl]benzene-1,4-dicarbohydrazide
CID 3554709
(Z)-N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenylprop-2-enehydrazide
CID 93027879

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide?
The IUPAC name of 3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide (CID 5088874) is 3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide.
What is the SMILES notation for 3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide?
The canonical SMILES for 3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide is O=C(C=Cc1ccccc1)NNC(=O)COc1ccccc1-c1ccccc1.
What is the InChIKey of 3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide?
The InChIKey is UZZABTFWNHZZTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3/c26-22(16-15-18-9-3-1-4-10-18)24-25-23(27)17-28-21-14-8-7-13-20(21)19-11-5-2-6-12-19/h1-16H,17H2,(H,24,26)(H,25,27).
What are the key properties of 3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide?
3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide has a molecular weight of 372.42 g/mol, XLogP of 3.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-N'-[2-(2-phenylphenoxy)acetyl]prop-2-enehydrazide is sourced from PubChem (CID 5088874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).