N'-(6-chloropyridazin-3-yl)acetohydrazide

C6H7ClN4O — CID 13016474

IUPACN'-(6-chloropyridazin-3-yl)acetohydrazide
SMILESCC(=O)NNc1ccc(Cl)nn1
InChIInChI=1S/C6H7ClN4O/c1-4(12)8-10-6-3-2-5(7)9-11-6/h2-3H,1H3,(H,8,12)(H,10,11)
InChIKeyAHMHIXQCYLMVAD-UHFFFAOYSA-N
MW186.60 g/mol
LogP0.59
Rot. Bonds2

About N'-(6-chloropyridazin-3-yl)acetohydrazide

N'-(6-chloropyridazin-3-yl)acetohydrazide (PubChem CID 13016474) has the molecular formula C6H7ClN4O and a molecular weight of 186.60 g/mol. Its IUPAC name is N'-(6-chloropyridazin-3-yl)acetohydrazide.

Molecular Properties

Compound NameN'-(6-chloropyridazin-3-yl)acetohydrazide
PubChem CID13016474
Molecular FormulaC6H7ClN4O
Molecular Weight186.60 g/mol
Exact Mass186.03
IUPAC NameN'-(6-chloropyridazin-3-yl)acetohydrazide
SMILESCC(=O)NNc1ccc(Cl)nn1
InChIInChI=1S/C6H7ClN4O/c1-4(12)8-10-6-3-2-5(7)9-11-6/h2-3H,1H3,(H,8,12)(H,10,11)
InChIKeyAHMHIXQCYLMVAD-UHFFFAOYSA-N
XLogP0.59
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.60
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(6-chloropyridazin-3-yl)acetohydrazide?
The IUPAC name of N'-(6-chloropyridazin-3-yl)acetohydrazide (CID 13016474) is N'-(6-chloropyridazin-3-yl)acetohydrazide.
What is the SMILES notation for N'-(6-chloropyridazin-3-yl)acetohydrazide?
The canonical SMILES for N'-(6-chloropyridazin-3-yl)acetohydrazide is CC(=O)NNc1ccc(Cl)nn1.
What is the InChIKey of N'-(6-chloropyridazin-3-yl)acetohydrazide?
The InChIKey is AHMHIXQCYLMVAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClN4O/c1-4(12)8-10-6-3-2-5(7)9-11-6/h2-3H,1H3,(H,8,12)(H,10,11).
What are the key properties of N'-(6-chloropyridazin-3-yl)acetohydrazide?
N'-(6-chloropyridazin-3-yl)acetohydrazide has a molecular weight of 186.60 g/mol, XLogP of 0.59, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(6-chloropyridazin-3-yl)acetohydrazide is sourced from PubChem (CID 13016474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).