thieno[2,3-d]pyrimidin-2-ylhydrazine

C6H6N4S — CID 91053414

IUPACthieno[2,3-d]pyrimidin-2-ylhydrazine
SMILESNNc1ncc2ccsc2n1
InChIInChI=1S/C6H6N4S/c7-10-6-8-3-4-1-2-11-5(4)9-6/h1-3H,7H2,(H,8,9,10)
InChIKeyGQEDPIMHHWXXBI-UHFFFAOYSA-N
MW166.21 g/mol
LogP0.98
Rot. Bonds1

About thieno[2,3-d]pyrimidin-2-ylhydrazine

thieno[2,3-d]pyrimidin-2-ylhydrazine (PubChem CID 91053414) has the molecular formula C6H6N4S and a molecular weight of 166.21 g/mol. Its IUPAC name is thieno[2,3-d]pyrimidin-2-ylhydrazine.

Molecular Properties

Compound Namethieno[2,3-d]pyrimidin-2-ylhydrazine
PubChem CID91053414
Molecular FormulaC6H6N4S
Molecular Weight166.21 g/mol
Exact Mass166.03
IUPAC Namethieno[2,3-d]pyrimidin-2-ylhydrazine
SMILESNNc1ncc2ccsc2n1
InChIInChI=1S/C6H6N4S/c7-10-6-8-3-4-1-2-11-5(4)9-6/h1-3H,7H2,(H,8,9,10)
InChIKeyGQEDPIMHHWXXBI-UHFFFAOYSA-N
XLogP0.98
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.21
LogP ≤ 50.98
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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Frequently Asked Questions

What is the IUPAC name of thieno[2,3-d]pyrimidin-2-ylhydrazine?
The IUPAC name of thieno[2,3-d]pyrimidin-2-ylhydrazine (CID 91053414) is thieno[2,3-d]pyrimidin-2-ylhydrazine.
What is the SMILES notation for thieno[2,3-d]pyrimidin-2-ylhydrazine?
The canonical SMILES for thieno[2,3-d]pyrimidin-2-ylhydrazine is NNc1ncc2ccsc2n1.
What is the InChIKey of thieno[2,3-d]pyrimidin-2-ylhydrazine?
The InChIKey is GQEDPIMHHWXXBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4S/c7-10-6-8-3-4-1-2-11-5(4)9-6/h1-3H,7H2,(H,8,9,10).
What are the key properties of thieno[2,3-d]pyrimidin-2-ylhydrazine?
thieno[2,3-d]pyrimidin-2-ylhydrazine has a molecular weight of 166.21 g/mol, XLogP of 0.98, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for thieno[2,3-d]pyrimidin-2-ylhydrazine is sourced from PubChem (CID 91053414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).