[6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine

C12H14N6S — CID 65198254

IUPAC[6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCCc1cc2c(NN)nc(-c3cnn(C)c3)nc2s1
InChIInChI=1S/C12H14N6S/c1-3-8-4-9-11(17-13)15-10(16-12(9)19-8)7-5-14-18(2)6-7/h4-6H,3,13H2,1-2H3,(H,15,16,17)
InChIKeyYGGMFZVABJFUQH-UHFFFAOYSA-N
MW274.35 g/mol
LogP1.94
Rot. Bonds3

About [6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine

[6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine (PubChem CID 65198254) has the molecular formula C12H14N6S and a molecular weight of 274.35 g/mol. Its IUPAC name is [6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
PubChem CID65198254
Molecular FormulaC12H14N6S
Molecular Weight274.35 g/mol
Exact Mass274.10
IUPAC Name[6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCCc1cc2c(NN)nc(-c3cnn(C)c3)nc2s1
InChIInChI=1S/C12H14N6S/c1-3-8-4-9-11(17-13)15-10(16-12(9)19-8)7-5-14-18(2)6-7/h4-6H,3,13H2,1-2H3,(H,15,16,17)
InChIKeyYGGMFZVABJFUQH-UHFFFAOYSA-N
XLogP1.94
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 51.94
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'}

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Frequently Asked Questions

What is the IUPAC name of [6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine (CID 65198254) is [6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine is CCc1cc2c(NN)nc(-c3cnn(C)c3)nc2s1.
What is the InChIKey of [6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The InChIKey is YGGMFZVABJFUQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6S/c1-3-8-4-9-11(17-13)15-10(16-12(9)19-8)7-5-14-18(2)6-7/h4-6H,3,13H2,1-2H3,(H,15,16,17).
What are the key properties of [6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine?
[6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine has a molecular weight of 274.35 g/mol, XLogP of 1.94, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [6-ethyl-2-(1-methylpyrazol-4-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 65198254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).