[2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine

C13H14ClFN4O — CID 103375753

IUPAC[2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine
SMILESCOc1ccc(C(Cc2cc(Cl)ccc2F)NN)nn1
InChIInChI=1S/C13H14ClFN4O/c1-20-13-5-4-11(18-19-13)12(17-16)7-8-6-9(14)2-3-10(8)15/h2-6,12,17H,7,16H2,1H3
InChIKeyKDQGECRRIACSPG-UHFFFAOYSA-N
MW296.73 g/mol
LogP2.02
Rot. Bonds5

About [2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine

[2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine (PubChem CID 103375753) has the molecular formula C13H14ClFN4O and a molecular weight of 296.73 g/mol. Its IUPAC name is [2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine
PubChem CID103375753
Molecular FormulaC13H14ClFN4O
Molecular Weight296.73 g/mol
Exact Mass296.08
IUPAC Name[2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine
SMILESCOc1ccc(C(Cc2cc(Cl)ccc2F)NN)nn1
InChIInChI=1S/C13H14ClFN4O/c1-20-13-5-4-11(18-19-13)12(17-16)7-8-6-9(14)2-3-10(8)15/h2-6,12,17H,7,16H2,1H3
InChIKeyKDQGECRRIACSPG-UHFFFAOYSA-N
XLogP2.02
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.73
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol
CID 103373520
2-(4-chloro-2-fluorophenyl)-N-ethyl-1-(6-methoxypyridazin-3-yl)ethanamine
CID 103374657
[1-(6-methoxypyridazin-3-yl)-2-(2-methylphenyl)ethyl]hydrazine
CID 103375674
[2-(5-chloro-2-fluorophenyl)-1-(2-methoxyphenyl)ethyl]hydrazine
CID 103053488
[1-(6-methoxypyridazin-3-yl)-2-(4-propan-2-ylphenyl)ethyl]hydrazine
CID 103375631
[2-(5-chloro-2-fluorophenyl)-1-pyridin-4-ylethyl]hydrazine
CID 103053503
[2-(5-chloro-2-fluorophenyl)-1-(2-methyl-1,3-thiazol-4-yl)ethyl]hydrazine
CID 103053824
[2-methoxy-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine
CID 103375615
[2-(5-chloro-2-fluorophenyl)-1-(2-methoxy-5-methylphenyl)ethyl]hydrazine
CID 103053830
[2-(5-bromo-2-fluorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine
CID 102953441
[2-(5-chloro-2-fluorophenyl)-1-(4-chloro-2-methylphenyl)ethyl]hydrazine
CID 114028450
[2-(furan-2-yl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine
CID 103375716

Frequently Asked Questions

What is the IUPAC name of [2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine (CID 103375753) is [2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine is COc1ccc(C(Cc2cc(Cl)ccc2F)NN)nn1.
What is the InChIKey of [2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine?
The InChIKey is KDQGECRRIACSPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClFN4O/c1-20-13-5-4-11(18-19-13)12(17-16)7-8-6-9(14)2-3-10(8)15/h2-6,12,17H,7,16H2,1H3.
What are the key properties of [2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine?
[2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine has a molecular weight of 296.73 g/mol, XLogP of 2.02, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]hydrazine is sourced from PubChem (CID 103375753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).