4-bromo-3-methoxy-6-methylpyridazine

C6H7BrN2O — CID 83680576

IUPAC4-bromo-3-methoxy-6-methylpyridazine
SMILESCOc1nnc(C)cc1Br
InChIInChI=1S/C6H7BrN2O/c1-4-3-5(7)6(10-2)9-8-4/h3H,1-2H3
InChIKeyAZCGDVMYWBSFOK-UHFFFAOYSA-N
MW203.04 g/mol
LogP1.56
Rot. Bonds1

About 4-bromo-3-methoxy-6-methylpyridazine

4-bromo-3-methoxy-6-methylpyridazine (PubChem CID 83680576) has the molecular formula C6H7BrN2O and a molecular weight of 203.04 g/mol. Its IUPAC name is 4-bromo-3-methoxy-6-methylpyridazine.

Molecular Properties

Compound Name4-bromo-3-methoxy-6-methylpyridazine
PubChem CID83680576
Molecular FormulaC6H7BrN2O
Molecular Weight203.04 g/mol
Exact Mass201.97
IUPAC Name4-bromo-3-methoxy-6-methylpyridazine
SMILESCOc1nnc(C)cc1Br
InChIInChI=1S/C6H7BrN2O/c1-4-3-5(7)6(10-2)9-8-4/h3H,1-2H3
InChIKeyAZCGDVMYWBSFOK-UHFFFAOYSA-N
XLogP1.56
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.04
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-3-methoxy-6-methylpyridazine?
The IUPAC name of 4-bromo-3-methoxy-6-methylpyridazine (CID 83680576) is 4-bromo-3-methoxy-6-methylpyridazine.
What is the SMILES notation for 4-bromo-3-methoxy-6-methylpyridazine?
The canonical SMILES for 4-bromo-3-methoxy-6-methylpyridazine is COc1nnc(C)cc1Br.
What is the InChIKey of 4-bromo-3-methoxy-6-methylpyridazine?
The InChIKey is AZCGDVMYWBSFOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7BrN2O/c1-4-3-5(7)6(10-2)9-8-4/h3H,1-2H3.
What are the key properties of 4-bromo-3-methoxy-6-methylpyridazine?
4-bromo-3-methoxy-6-methylpyridazine has a molecular weight of 203.04 g/mol, XLogP of 1.56, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-3-methoxy-6-methylpyridazine is sourced from PubChem (CID 83680576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).