2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide

C17H18N2O2 — CID 54848554

IUPAC2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide
SMILESC=CCc1cc(-c2ccccc2)ccc1OCC(=O)NN
InChIInChI=1S/C17H18N2O2/c1-2-6-15-11-14(13-7-4-3-5-8-13)9-10-16(15)21-12-17(20)19-18/h2-5,7-11H,1,6,12,18H2,(H,19,20)
InChIKeyREZAUXPTEOJUCF-UHFFFAOYSA-N
MW282.34 g/mol
LogP2.45
Rot. Bonds6

About 2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide

2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide (PubChem CID 54848554) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is 2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide.

Molecular Properties

Compound Name2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide
PubChem CID54848554
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide
SMILESC=CCc1cc(-c2ccccc2)ccc1OCC(=O)NN
InChIInChI=1S/C17H18N2O2/c1-2-6-15-11-14(13-7-4-3-5-8-13)9-10-16(15)21-12-17(20)19-18/h2-5,7-11H,1,6,12,18H2,(H,19,20)
InChIKeyREZAUXPTEOJUCF-UHFFFAOYSA-N
XLogP2.45
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene
CID 155642904
2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide
CID 764178
N-(2-chlorophenyl)-2-(4-nitro-2-prop-2-enylphenoxy)acetamide
CID 7577886
2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide
CID 54849931
N-cyclopropyl-2-(4-nitro-2-prop-2-enylphenoxy)acetamide
CID 7578073
2-(2-bromo-4-phenylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide
CID 17098032
2-(2-chloro-4-phenylphenoxy)-N-methylacetamide
CID 17466417
N-(3-bromophenyl)-2-(2-prop-2-enylphenoxy)acetamide
CID 1407053
N-cyclohexyl-2-(2-prop-2-enylphenoxy)acetamide
CID 1406994
N-(2-methoxyethyl)-2-(2-prop-2-enylphenoxy)acetamide
CID 2072678
N-(2-methoxy-5-nitrophenyl)-2-(4-nitro-2-prop-2-enylphenoxy)acetamide
CID 7578310
N'-[2-(2-bromo-4-phenylphenoxy)acetyl]-2-prop-2-enoxybenzohydrazide
CID 4960851

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide?
The IUPAC name of 2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide (CID 54848554) is 2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide.
What is the SMILES notation for 2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide?
The canonical SMILES for 2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide is C=CCc1cc(-c2ccccc2)ccc1OCC(=O)NN.
What is the InChIKey of 2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide?
The InChIKey is REZAUXPTEOJUCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-2-6-15-11-14(13-7-4-3-5-8-13)9-10-16(15)21-12-17(20)19-18/h2-5,7-11H,1,6,12,18H2,(H,19,20).
What are the key properties of 2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide?
2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide has a molecular weight of 282.34 g/mol, XLogP of 2.45, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide is sourced from PubChem (CID 54848554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).