(6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine

C8H14N4S — CID 10821822

IUPAC(6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine
SMILESCc1cc(NN)nc(SC(C)C)n1
InChIInChI=1S/C8H14N4S/c1-5(2)13-8-10-6(3)4-7(11-8)12-9/h4-5H,9H2,1-3H3,(H,10,11,12)
InChIKeyYJNKHPJNMPWGPU-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.57
Rot. Bonds3

About (6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine

(6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine (PubChem CID 10821822) has the molecular formula C8H14N4S and a molecular weight of 198.29 g/mol. Its IUPAC name is (6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine
PubChem CID10821822
Molecular FormulaC8H14N4S
Molecular Weight198.29 g/mol
Exact Mass198.09
IUPAC Name(6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine
SMILESCc1cc(NN)nc(SC(C)C)n1
InChIInChI=1S/C8H14N4S/c1-5(2)13-8-10-6(3)4-7(11-8)12-9/h4-5H,9H2,1-3H3,(H,10,11,12)
InChIKeyYJNKHPJNMPWGPU-UHFFFAOYSA-N
XLogP1.57
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.57
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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Frequently Asked Questions

What is the IUPAC name of (6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine?
The IUPAC name of (6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine (CID 10821822) is (6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for (6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine?
The canonical SMILES for (6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine is Cc1cc(NN)nc(SC(C)C)n1.
What is the InChIKey of (6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine?
The InChIKey is YJNKHPJNMPWGPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4S/c1-5(2)13-8-10-6(3)4-7(11-8)12-9/h4-5H,9H2,1-3H3,(H,10,11,12).
What are the key properties of (6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine?
(6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine has a molecular weight of 198.29 g/mol, XLogP of 1.57, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-2-propan-2-ylsulfanylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 10821822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).