[4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine

C13H20N6S — CID 103335844

IUPAC[4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
SMILESCC1CN(c2nc(NN)nc3sccc23)CC(C)N1C
InChIInChI=1S/C13H20N6S/c1-8-6-19(7-9(2)18(8)3)11-10-4-5-20-12(10)16-13(15-11)17-14/h4-5,8-9H,6-7,14H2,1-3H3,(H,15,16,17)
InChIKeyBJPBABXHRMORQI-UHFFFAOYSA-N
MW292.41 g/mol
LogP1.51
Rot. Bonds2

About [4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine

[4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine (PubChem CID 103335844) has the molecular formula C13H20N6S and a molecular weight of 292.41 g/mol. Its IUPAC name is [4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
PubChem CID103335844
Molecular FormulaC13H20N6S
Molecular Weight292.41 g/mol
Exact Mass292.15
IUPAC Name[4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
SMILESCC1CN(c2nc(NN)nc3sccc23)CC(C)N1C
InChIInChI=1S/C13H20N6S/c1-8-6-19(7-9(2)18(8)3)11-10-4-5-20-12(10)16-13(15-11)17-14/h4-5,8-9H,6-7,14H2,1-3H3,(H,15,16,17)
InChIKeyBJPBABXHRMORQI-UHFFFAOYSA-N
XLogP1.51
TPSA70.31 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.41
LogP ≤ 51.51
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-(3,4,5-trimethylpiperazin-1-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-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The IUPAC name of [4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine (CID 103335844) is [4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine.
What is the SMILES notation for [4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The canonical SMILES for [4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine is CC1CN(c2nc(NN)nc3sccc23)CC(C)N1C.
What is the InChIKey of [4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The InChIKey is BJPBABXHRMORQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N6S/c1-8-6-19(7-9(2)18(8)3)11-10-4-5-20-12(10)16-13(15-11)17-14/h4-5,8-9H,6-7,14H2,1-3H3,(H,15,16,17).
What are the key properties of [4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
[4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine has a molecular weight of 292.41 g/mol, XLogP of 1.51, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine is sourced from PubChem (CID 103335844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).