[(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine

C13H15ClN4O2 — CID 103375610

IUPAC[(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2ccc(Cl)c(OC)c2)nn1
InChIInChI=1S/C13H15ClN4O2/c1-19-11-7-8(3-4-9(11)14)13(16-15)10-5-6-12(20-2)18-17-10/h3-7,13,16H,15H2,1-2H3
InChIKeyUKBQHSXRRISGAS-UHFFFAOYSA-N
MW294.74 g/mol
LogP1.70
Rot. Bonds5

About [(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine

[(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine (PubChem CID 103375610) has the molecular formula C13H15ClN4O2 and a molecular weight of 294.74 g/mol. Its IUPAC name is [(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine
PubChem CID103375610
Molecular FormulaC13H15ClN4O2
Molecular Weight294.74 g/mol
Exact Mass294.09
IUPAC Name[(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2ccc(Cl)c(OC)c2)nn1
InChIInChI=1S/C13H15ClN4O2/c1-19-11-7-8(3-4-9(11)14)13(16-15)10-5-6-12(20-2)18-17-10/h3-7,13,16H,15H2,1-2H3
InChIKeyUKBQHSXRRISGAS-UHFFFAOYSA-N
XLogP1.70
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.74
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine?
The IUPAC name of [(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine (CID 103375610) is [(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine.
What is the SMILES notation for [(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine?
The canonical SMILES for [(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine is COc1ccc(C(NN)c2ccc(Cl)c(OC)c2)nn1.
What is the InChIKey of [(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine?
The InChIKey is UKBQHSXRRISGAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN4O2/c1-19-11-7-8(3-4-9(11)14)13(16-15)10-5-6-12(20-2)18-17-10/h3-7,13,16H,15H2,1-2H3.
What are the key properties of [(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine?
[(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine has a molecular weight of 294.74 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine is sourced from PubChem (CID 103375610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).