1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine

C17H15ClN4O — CID 169386146

IUPAC1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine
SMILESClc1ccc(Oc2ccc(CNNc3ccccc3)cc2)nn1
InChIInChI=1S/C17H15ClN4O/c18-16-10-11-17(22-21-16)23-15-8-6-13(7-9-15)12-19-20-14-4-2-1-3-5-14/h1-11,19-20H,12H2
InChIKeyZMWRWHRLVLKVMD-UHFFFAOYSA-N
MW326.79 g/mol
LogP4.04
Rot. Bonds6

About 1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine

1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine (PubChem CID 169386146) has the molecular formula C17H15ClN4O and a molecular weight of 326.79 g/mol. Its IUPAC name is 1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine
PubChem CID169386146
Molecular FormulaC17H15ClN4O
Molecular Weight326.79 g/mol
Exact Mass326.09
IUPAC Name1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine
SMILESClc1ccc(Oc2ccc(CNNc3ccccc3)cc2)nn1
InChIInChI=1S/C17H15ClN4O/c18-16-10-11-17(22-21-16)23-15-8-6-13(7-9-15)12-19-20-14-4-2-1-3-5-14/h1-11,19-20H,12H2
InChIKeyZMWRWHRLVLKVMD-UHFFFAOYSA-N
XLogP4.04
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.79
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine?
The IUPAC name of 1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine (CID 169386146) is 1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine?
The canonical SMILES for 1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine is Clc1ccc(Oc2ccc(CNNc3ccccc3)cc2)nn1.
What is the InChIKey of 1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine?
The InChIKey is ZMWRWHRLVLKVMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN4O/c18-16-10-11-17(22-21-16)23-15-8-6-13(7-9-15)12-19-20-14-4-2-1-3-5-14/h1-11,19-20H,12H2.
What are the key properties of 1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine?
1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine has a molecular weight of 326.79 g/mol, XLogP of 4.04, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-(6-chloropyridazin-3-yl)oxyphenyl]methyl]-2-phenylhydrazine is sourced from PubChem (CID 169386146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).