[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine

C11H19N5O2S — CID 80963982

IUPAC[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCC(C)c1nc(NN)cc(N2CCS(=O)(=O)CC2)n1
InChIInChI=1S/C11H19N5O2S/c1-8(2)11-13-9(15-12)7-10(14-11)16-3-5-19(17,18)6-4-16/h7-8H,3-6,12H2,1-2H3,(H,13,14,15)
InChIKeyHMFFDERWHZCLSG-UHFFFAOYSA-N
MW285.37 g/mol
LogP0.12
Rot. Bonds3

About [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine

[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 80963982) has the molecular formula C11H19N5O2S and a molecular weight of 285.37 g/mol. Its IUPAC name is [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID80963982
Molecular FormulaC11H19N5O2S
Molecular Weight285.37 g/mol
Exact Mass285.13
IUPAC Name[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCC(C)c1nc(NN)cc(N2CCS(=O)(=O)CC2)n1
InChIInChI=1S/C11H19N5O2S/c1-8(2)11-13-9(15-12)7-10(14-11)16-3-5-19(17,18)6-4-16/h7-8H,3-6,12H2,1-2H3,(H,13,14,15)
InChIKeyHMFFDERWHZCLSG-UHFFFAOYSA-N
XLogP0.12
TPSA101.21 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine (CID 80963982) is [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine is CC(C)c1nc(NN)cc(N2CCS(=O)(=O)CC2)n1.
What is the InChIKey of [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is HMFFDERWHZCLSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O2S/c1-8(2)11-13-9(15-12)7-10(14-11)16-3-5-19(17,18)6-4-16/h7-8H,3-6,12H2,1-2H3,(H,13,14,15).
What are the key properties of [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 285.37 g/mol, XLogP of 0.12, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80963982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).