N-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide

C10H12ClN3O2 — CID 57054215

IUPACN-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide
SMILESC=C(NON(N)C(C)=O)c1ccc(Cl)cc1
InChIInChI=1S/C10H12ClN3O2/c1-7(13-16-14(12)8(2)15)9-3-5-10(11)6-4-9/h3-6,13H,1,12H2,2H3
InChIKeyPUCVHZBYXSQBQK-UHFFFAOYSA-N
MW241.68 g/mol
LogP1.47
Rot. Bonds4

About N-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide

N-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide (PubChem CID 57054215) has the molecular formula C10H12ClN3O2 and a molecular weight of 241.68 g/mol. Its IUPAC name is N-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide.

Molecular Properties

Compound NameN-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide
PubChem CID57054215
Molecular FormulaC10H12ClN3O2
Molecular Weight241.68 g/mol
Exact Mass241.06
IUPAC NameN-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide
SMILESC=C(NON(N)C(C)=O)c1ccc(Cl)cc1
InChIInChI=1S/C10H12ClN3O2/c1-7(13-16-14(12)8(2)15)9-3-5-10(11)6-4-9/h3-6,13H,1,12H2,2H3
InChIKeyPUCVHZBYXSQBQK-UHFFFAOYSA-N
XLogP1.47
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.68
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(4-Chlorophenyl)-1H-pyrazol-5-ol
CID 606590
5-(4-Chloro-phenyl)-2-methyl-2H-pyrazol-3-ol
CID 23150870
Hydrazine, 1-acetyl-2-(p-chloro-alpha-methylbenzyl)-
CID 3052821
6-(4-Chlorophenyl)-1,2-dihydropyridazine-3,4-dione
CID 790054
1-Methyl-5-hydroxy-3-(2-fluoro-4-chlorophenyl)pyrazole
CID 11736296
5-(4-Chlorophenyl)-4-fluoro-1,2-dihydropyrazol-3-one
CID 12859030
5-(4-chlorophenyl)-4-fluoro-2-methyl-1H-pyrazol-3-one
CID 12859035
5-(4-Chloro-2-fluorophenyl)-4-methyl-1,2-dihydropyrazol-3-one
CID 57110587
5-(4-chlorophenyl)-1,2-dihydro-1-methyl-3H-pyrazol-3-one
CID 58361138
N'-[(4-chlorophenyl)methyl]acetohydrazide
CID 19882096
2-amino-5-(4-chlorophenyl)-1H-pyrazol-3-one
CID 20539645
2-tert-butyl-5-(4-chlorophenyl)-1H-pyrazol-3-one
CID 54508667

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide?
The IUPAC name of N-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide (CID 57054215) is N-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide.
What is the SMILES notation for N-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide?
The canonical SMILES for N-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide is C=C(NON(N)C(C)=O)c1ccc(Cl)cc1.
What is the InChIKey of N-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide?
The InChIKey is PUCVHZBYXSQBQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN3O2/c1-7(13-16-14(12)8(2)15)9-3-5-10(11)6-4-9/h3-6,13H,1,12H2,2H3.
What are the key properties of N-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide?
N-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide has a molecular weight of 241.68 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-chlorophenyl)ethenylamino]oxyacetohydrazide is sourced from PubChem (CID 57054215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).