[4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine

C12H17N5S2 — CID 103335812

IUPAC[4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
SMILESCC1(C)CN(c2nc(NN)nc3sccc23)CCS1
InChIInChI=1S/C12H17N5S2/c1-12(2)7-17(4-6-19-12)9-8-3-5-18-10(8)15-11(14-9)16-13/h3,5H,4,6-7,13H2,1-2H3,(H,14,15,16)
InChIKeyLPECEEVWNGVRDE-UHFFFAOYSA-N
MW295.44 g/mol
LogP2.31
Rot. Bonds2

About [4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine

[4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine (PubChem CID 103335812) has the molecular formula C12H17N5S2 and a molecular weight of 295.44 g/mol. Its IUPAC name is [4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
PubChem CID103335812
Molecular FormulaC12H17N5S2
Molecular Weight295.44 g/mol
Exact Mass295.09
IUPAC Name[4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
SMILESCC1(C)CN(c2nc(NN)nc3sccc23)CCS1
InChIInChI=1S/C12H17N5S2/c1-12(2)7-17(4-6-19-12)9-8-3-5-18-10(8)15-11(14-9)16-13/h3,5H,4,6-7,13H2,1-2H3,(H,14,15,16)
InChIKeyLPECEEVWNGVRDE-UHFFFAOYSA-N
XLogP2.31
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.44
LogP ≤ 52.31
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 [4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-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 [4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The IUPAC name of [4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine (CID 103335812) is [4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine.
What is the SMILES notation for [4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The canonical SMILES for [4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine is CC1(C)CN(c2nc(NN)nc3sccc23)CCS1.
What is the InChIKey of [4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The InChIKey is LPECEEVWNGVRDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5S2/c1-12(2)7-17(4-6-19-12)9-8-3-5-18-10(8)15-11(14-9)16-13/h3,5H,4,6-7,13H2,1-2H3,(H,14,15,16).
What are the key properties of [4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
[4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine has a molecular weight of 295.44 g/mol, XLogP of 2.31, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine is sourced from PubChem (CID 103335812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).