(6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine

C8H14N4S — CID 80925717

IUPAC(6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
SMILESCCSc1nc(C)nc(NN)c1C
InChIInChI=1S/C8H14N4S/c1-4-13-8-5(2)7(12-9)10-6(3)11-8/h4,9H2,1-3H3,(H,10,11,12)
InChIKeyBQFKBEKHLDGLEY-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.49
Rot. Bonds3

About (6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine

(6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine (PubChem CID 80925717) has the molecular formula C8H14N4S and a molecular weight of 198.29 g/mol. Its IUPAC name is (6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
PubChem CID80925717
Molecular FormulaC8H14N4S
Molecular Weight198.29 g/mol
Exact Mass198.09
IUPAC Name(6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
SMILESCCSc1nc(C)nc(NN)c1C
InChIInChI=1S/C8H14N4S/c1-4-13-8-5(2)7(12-9)10-6(3)11-8/h4,9H2,1-3H3,(H,10,11,12)
InChIKeyBQFKBEKHLDGLEY-UHFFFAOYSA-N
XLogP1.49
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 ≤ 51.49
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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Related Compounds

(6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
CID 80924800
(6-butan-2-ylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
CID 80925464
[6-(cyclopentylmethylsulfanyl)-2,5-dimethylpyrimidin-4-yl]hydrazine
CID 80930091
(6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
CID 80929974
[2-ethyl-5-methyl-6-(2-methylbutylsulfanyl)pyrimidin-4-yl]hydrazine
CID 107766327
[5-methyl-6-(2-methylbutylsulfanyl)-2-propylpyrimidin-4-yl]hydrazine
CID 107766364
3-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)sulfanyl-2-methylpropan-1-ol
CID 80996563
6-hydrazinyl-2,5-dimethyl-N-(2-methylbutyl)pyrimidin-4-amine
CID 80918838
(2-cyclopropyl-5-methyl-6-propylsulfanylpyrimidin-4-yl)hydrazine
CID 81000764
3-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)sulfanylpropan-1-ol
CID 80997107
N,N-diethyl-2-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)sulfanylethanamine
CID 80996460
[6-(3,4-difluorophenyl)sulfanyl-2,5-dimethylpyrimidin-4-yl]hydrazine
CID 80925558

Frequently Asked Questions

What is the IUPAC name of (6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine?
The IUPAC name of (6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine (CID 80925717) is (6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for (6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine?
The canonical SMILES for (6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine is CCSc1nc(C)nc(NN)c1C.
What is the InChIKey of (6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine?
The InChIKey is BQFKBEKHLDGLEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4S/c1-4-13-8-5(2)7(12-9)10-6(3)11-8/h4,9H2,1-3H3,(H,10,11,12).
What are the key properties of (6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine?
(6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine has a molecular weight of 198.29 g/mol, XLogP of 1.49, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 80925717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).