[2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine

C11H18N4S — CID 80979578

IUPAC[2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine
SMILESCC(C)CSc1cc(NN)nc(C2CC2)n1
InChIInChI=1S/C11H18N4S/c1-7(2)6-16-10-5-9(15-12)13-11(14-10)8-3-4-8/h5,7-8H,3-4,6,12H2,1-2H3,(H,13,14,15)
InChIKeyGHTOUTYAWDCYLL-UHFFFAOYSA-N
MW238.36 g/mol
LogP2.39
Rot. Bonds5

About [2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine

[2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine (PubChem CID 80979578) has the molecular formula C11H18N4S and a molecular weight of 238.36 g/mol. Its IUPAC name is [2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine
PubChem CID80979578
Molecular FormulaC11H18N4S
Molecular Weight238.36 g/mol
Exact Mass238.13
IUPAC Name[2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine
SMILESCC(C)CSc1cc(NN)nc(C2CC2)n1
InChIInChI=1S/C11H18N4S/c1-7(2)6-16-10-5-9(15-12)13-11(14-10)8-3-4-8/h5,7-8H,3-4,6,12H2,1-2H3,(H,13,14,15)
InChIKeyGHTOUTYAWDCYLL-UHFFFAOYSA-N
XLogP2.39
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 52.39
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-cyclopropyl-6-(3-methylbutan-2-ylsulfanyl)pyrimidin-4-yl]hydrazine
CID 107766282
[6-(2-methylpropylsulfanyl)-2-methylsulfanylpyrimidin-4-yl]hydrazine
CID 80925282
[6-(2-methylpropylsulfanyl)-2-propylpyrimidin-4-yl]hydrazine
CID 80947009
[6-[(4-chlorophenyl)methylsulfanyl]-2-cyclopropylpyrimidin-4-yl]hydrazine
CID 114793160
2-cyclopropyl-6-hydrazinyl-N-(3-methylbutyl)pyrimidin-4-amine
CID 80969047
2-cyclopropyl-6-ethylsulfanyl-N-methylpyrimidin-4-amine
CID 80962555
(2-cyclopropyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine
CID 80979379
[6-(2-methylpropylsulfanyl)-2-pyridinyl]hydrazine
CID 80924851
2-cyclopropyl-6-hydrazinyl-N-(2-methylbutyl)pyrimidin-4-amine
CID 80964832
[2-cyclopropyl-6-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]pyrimidin-4-yl]hydrazine
CID 80980174
[6-propan-2-yl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]hydrazine
CID 65400565
[2-cyclopropyl-6-(2,5-difluorophenyl)sulfanylpyrimidin-4-yl]hydrazine
CID 80980397

Frequently Asked Questions

What is the IUPAC name of [2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine (CID 80979578) is [2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine is CC(C)CSc1cc(NN)nc(C2CC2)n1.
What is the InChIKey of [2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine?
The InChIKey is GHTOUTYAWDCYLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4S/c1-7(2)6-16-10-5-9(15-12)13-11(14-10)8-3-4-8/h5,7-8H,3-4,6,12H2,1-2H3,(H,13,14,15).
What are the key properties of [2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine?
[2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine has a molecular weight of 238.36 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclopropyl-6-(2-methylpropylsulfanyl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80979578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).