[2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine

C11H20N4S — CID 107766316

IUPAC[2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine
SMILESCCc1nc(NN)cc(SC(C)C(C)C)n1
InChIInChI=1S/C11H20N4S/c1-5-9-13-10(15-12)6-11(14-9)16-8(4)7(2)3/h6-8H,5,12H2,1-4H3,(H,13,14,15)
InChIKeyGOXVTTNYZCRADZ-UHFFFAOYSA-N
MW240.38 g/mol
LogP2.46
Rot. Bonds5

About [2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine

[2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine (PubChem CID 107766316) has the molecular formula C11H20N4S and a molecular weight of 240.38 g/mol. Its IUPAC name is [2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine
PubChem CID107766316
Molecular FormulaC11H20N4S
Molecular Weight240.38 g/mol
Exact Mass240.14
IUPAC Name[2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine
SMILESCCc1nc(NN)cc(SC(C)C(C)C)n1
InChIInChI=1S/C11H20N4S/c1-5-9-13-10(15-12)6-11(14-9)16-8(4)7(2)3/h6-8H,5,12H2,1-4H3,(H,13,14,15)
InChIKeyGOXVTTNYZCRADZ-UHFFFAOYSA-N
XLogP2.46
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.38
LogP ≤ 52.46
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

2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-amine
CID 107765529
[2-cyclopropyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine
CID 107766282
[6-(3-methylbutan-2-ylsulfanyl)-2-(trifluoromethyl)pyrimidin-4-yl]hydrazine
CID 107766272
2-ethyl-6-hydrazinyl-N-propan-2-ylpyrimidin-4-amine
CID 80937642
3-(2-ethyl-6-hydrazinylpyrimidin-4-yl)sulfanylpropane-1,2-diol
CID 80938523
[6-(3-chlorophenyl)sulfanyl-2-ethylpyrimidin-4-yl]hydrazine
CID 80939919
[2-ethyl-6-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyrimidin-4-yl]hydrazine
CID 80938720
2-ethyl-6-hydrazinyl-N-pentan-2-ylpyrimidin-4-amine
CID 80940178
2-ethyl-6-hydrazinyl-N-(2-methyl-3-methylsulfanylpropyl)pyrimidin-4-amine
CID 80937623
[6-(2-methylpropylsulfanyl)-2-propylpyrimidin-4-yl]hydrazine
CID 80947009
methyl 3-(2-ethyl-6-hydrazinylpyrimidin-4-yl)sulfanylpropanoate
CID 80940205
[2-ethyl-6-(2-nitrophenyl)sulfanylpyrimidin-4-yl]hydrazine
CID 80939777

Frequently Asked Questions

What is the IUPAC name of [2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine (CID 107766316) is [2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine is CCc1nc(NN)cc(SC(C)C(C)C)n1.
What is the InChIKey of [2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine?
The InChIKey is GOXVTTNYZCRADZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4S/c1-5-9-13-10(15-12)6-11(14-9)16-8(4)7(2)3/h6-8H,5,12H2,1-4H3,(H,13,14,15).
What are the key properties of [2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine?
[2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine has a molecular weight of 240.38 g/mol, XLogP of 2.46, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 107766316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).