2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide

C11H12Cl2N2O2 — CID 54849931

IUPAC2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide
SMILESC=CCc1cc(Cl)cc(Cl)c1OCC(=O)NN
InChIInChI=1S/C11H12Cl2N2O2/c1-2-3-7-4-8(12)5-9(13)11(7)17-6-10(16)15-14/h2,4-5H,1,3,6,14H2,(H,15,16)
InChIKeyGZHUYAYULOJOHD-UHFFFAOYSA-N
MW275.13 g/mol
LogP2.09
Rot. Bonds5

About 2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide

2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide (PubChem CID 54849931) has the molecular formula C11H12Cl2N2O2 and a molecular weight of 275.13 g/mol. Its IUPAC name is 2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide.

Molecular Properties

Compound Name2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide
PubChem CID54849931
Molecular FormulaC11H12Cl2N2O2
Molecular Weight275.13 g/mol
Exact Mass274.03
IUPAC Name2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide
SMILESC=CCc1cc(Cl)cc(Cl)c1OCC(=O)NN
InChIInChI=1S/C11H12Cl2N2O2/c1-2-3-7-4-8(12)5-9(13)11(7)17-6-10(16)15-14/h2,4-5H,1,3,6,14H2,(H,15,16)
InChIKeyGZHUYAYULOJOHD-UHFFFAOYSA-N
XLogP2.09
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.13
LogP ≤ 52.09
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

2-[2,4-dichloro-6-[(prop-2-enylamino)methyl]phenoxy]acetamide
CID 6473574
1,5-dichloro-2-[[4-[(2,4-dichloro-6-prop-2-enylphenoxy)methyl]phenyl]methoxy]-3-prop-2-enylbenzene
CID 59551589
2-[2-(2-aminoethyl)-4,6-dichlorophenoxy]-N-methylacetamide
CID 54931009
2-[2,4-dichloro-6-(hydroxymethyl)phenoxy]-N-ethylacetamide
CID 43516177
2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide
CID 54848554
2-[2-(2-aminoethyl)-4,6-dichlorophenoxy]-N-(2-methylpropyl)acetamide
CID 60905923
2-(2-bromo-6-chloro-4-methylphenoxy)acetohydrazide
CID 54793109
2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide
CID 764178
2-[2-(2-aminobutyl)-4,6-dichlorophenoxy]-N-propan-2-ylacetamide
CID 60907916
2-[2,4-dichloro-6-(propylaminomethyl)phenoxy]-N-propan-2-ylacetamide
CID 43515791
2-[2,4-dichloro-6-(methylaminomethyl)phenoxy]-N-pentan-3-ylacetamide
CID 61486830
2-(2-bromo-4-tert-butyl-6-chlorophenoxy)acetohydrazide
CID 54793129

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide?
The IUPAC name of 2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide (CID 54849931) is 2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide.
What is the SMILES notation for 2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide?
The canonical SMILES for 2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide is C=CCc1cc(Cl)cc(Cl)c1OCC(=O)NN.
What is the InChIKey of 2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide?
The InChIKey is GZHUYAYULOJOHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12Cl2N2O2/c1-2-3-7-4-8(12)5-9(13)11(7)17-6-10(16)15-14/h2,4-5H,1,3,6,14H2,(H,15,16).
What are the key properties of 2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide?
2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide has a molecular weight of 275.13 g/mol, XLogP of 2.09, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichloro-6-prop-2-enylphenoxy)acetohydrazide is sourced from PubChem (CID 54849931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).