[2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine

C13H23N5S — CID 83056809

IUPAC[2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine
SMILESCCCC1CCCCN1c1cc(NN)nc(SC)n1
InChIInChI=1S/C13H23N5S/c1-3-6-10-7-4-5-8-18(10)12-9-11(17-14)15-13(16-12)19-2/h9-10H,3-8,14H2,1-2H3,(H,15,16,17)
InChIKeyJULAYNPPFZLVPR-UHFFFAOYSA-N
MW281.43 g/mol
LogP2.64
Rot. Bonds5

About [2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine

[2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine (PubChem CID 83056809) has the molecular formula C13H23N5S and a molecular weight of 281.43 g/mol. Its IUPAC name is [2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine
PubChem CID83056809
Molecular FormulaC13H23N5S
Molecular Weight281.43 g/mol
Exact Mass281.17
IUPAC Name[2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine
SMILESCCCC1CCCCN1c1cc(NN)nc(SC)n1
InChIInChI=1S/C13H23N5S/c1-3-6-10-7-4-5-8-18(10)12-9-11(17-14)15-13(16-12)19-2/h9-10H,3-8,14H2,1-2H3,(H,15,16,17)
InChIKeyJULAYNPPFZLVPR-UHFFFAOYSA-N
XLogP2.64
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.43
LogP ≤ 52.64
H-Bond Donors ≤ 52
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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Related Compounds

2-methylsulfanyl-N-propyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-amine
CID 83045067
[2-cyclopropyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine
CID 83056734
4-hydrazinyl-6-(2-propylpiperidin-1-yl)pyrimidin-2-amine
CID 83057547
2-[1-[6-(ethylamino)-2-methylsulfanylpyrimidin-4-yl]piperidin-2-yl]ethanol
CID 80766985
[6-(2-methylpyrrolidin-1-yl)-2-methylsulfanylpyrimidin-4-yl]hydrazine
CID 80898992
[6-(2-propylpiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 102721064
[6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-methylsulfanylpyrimidin-4-yl]hydrazine
CID 80930524
2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol
CID 80927450
4-methyl-6-(2-propylpiperidin-1-yl)pyrimidin-2-amine
CID 83056730
[1-(6-chloro-2-methylsulfanylpyrimidin-4-yl)piperidin-2-yl]methanamine
CID 71643169
[1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)azepan-2-yl]methanol
CID 116640797
6-(2-methylpyrrolidin-1-yl)-2-methylsulfanyl-N-propylpyrimidin-4-amine
CID 80791344

Frequently Asked Questions

What is the IUPAC name of [2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine (CID 83056809) is [2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine is CCCC1CCCCN1c1cc(NN)nc(SC)n1.
What is the InChIKey of [2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine?
The InChIKey is JULAYNPPFZLVPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5S/c1-3-6-10-7-4-5-8-18(10)12-9-11(17-14)15-13(16-12)19-2/h9-10H,3-8,14H2,1-2H3,(H,15,16,17).
What are the key properties of [2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine?
[2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine has a molecular weight of 281.43 g/mol, XLogP of 2.64, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methylsulfanyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 83056809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).