6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine

C6H11N5S — CID 59650283

IUPAC6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine
SMILESCNc1cc(NN)nc(SC)n1
InChIInChI=1S/C6H11N5S/c1-8-4-3-5(11-7)10-6(9-4)12-2/h3H,7H2,1-2H3,(H2,8,9,10,11)
InChIKeyYRZOWZITLIAJGG-UHFFFAOYSA-N
MW185.26 g/mol
LogP0.53
Rot. Bonds3

About 6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine

6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine (PubChem CID 59650283) has the molecular formula C6H11N5S and a molecular weight of 185.26 g/mol. Its IUPAC name is 6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine
PubChem CID59650283
Molecular FormulaC6H11N5S
Molecular Weight185.26 g/mol
Exact Mass185.07
IUPAC Name6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine
SMILESCNc1cc(NN)nc(SC)n1
InChIInChI=1S/C6H11N5S/c1-8-4-3-5(11-7)10-6(9-4)12-2/h3H,7H2,1-2H3,(H2,8,9,10,11)
InChIKeyYRZOWZITLIAJGG-UHFFFAOYSA-N
XLogP0.53
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.26
LogP ≤ 50.53
H-Bond Donors ≤ 53
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 6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine (CID 59650283) is 6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine is CNc1cc(NN)nc(SC)n1.
What is the InChIKey of 6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine?
The InChIKey is YRZOWZITLIAJGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N5S/c1-8-4-3-5(11-7)10-6(9-4)12-2/h3H,7H2,1-2H3,(H2,8,9,10,11).
What are the key properties of 6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine?
6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine has a molecular weight of 185.26 g/mol, XLogP of 0.53, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine is sourced from PubChem (CID 59650283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).