1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine

C6H9BrN4S — CID 22323969

IUPAC1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine
SMILESCSc1ncc(Br)c(N(C)N)n1
InChIInChI=1S/C6H9BrN4S/c1-11(8)5-4(7)3-9-6(10-5)12-2/h3H,8H2,1-2H3
InChIKeyWEAKTINXXKPSDX-UHFFFAOYSA-N
MW249.14 g/mol
LogP1.27
Rot. Bonds2

About 1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine

1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine (PubChem CID 22323969) has the molecular formula C6H9BrN4S and a molecular weight of 249.14 g/mol. Its IUPAC name is 1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine.

Molecular Properties

Compound Name1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine
PubChem CID22323969
Molecular FormulaC6H9BrN4S
Molecular Weight249.14 g/mol
Exact Mass247.97
IUPAC Name1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine
SMILESCSc1ncc(Br)c(N(C)N)n1
InChIInChI=1S/C6H9BrN4S/c1-11(8)5-4(7)3-9-6(10-5)12-2/h3H,8H2,1-2H3
InChIKeyWEAKTINXXKPSDX-UHFFFAOYSA-N
XLogP1.27
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.14
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine?
The IUPAC name of 1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine (CID 22323969) is 1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine.
What is the SMILES notation for 1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine?
The canonical SMILES for 1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine is CSc1ncc(Br)c(N(C)N)n1.
What is the InChIKey of 1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine?
The InChIKey is WEAKTINXXKPSDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9BrN4S/c1-11(8)5-4(7)3-9-6(10-5)12-2/h3H,8H2,1-2H3.
What are the key properties of 1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine?
1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine has a molecular weight of 249.14 g/mol, XLogP of 1.27, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-2-methylsulfanylpyrimidin-4-yl)-1-methylhydrazine is sourced from PubChem (CID 22323969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).