[(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine

C11H14N4OS — CID 105254414

IUPAC[(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine
SMILESCCOc1cncc(C(NN)c2cscn2)c1
InChIInChI=1S/C11H14N4OS/c1-2-16-9-3-8(4-13-5-9)11(15-12)10-6-17-7-14-10/h3-7,11,15H,2,12H2,1H3
InChIKeyRJHJDAIEUNIOQO-UHFFFAOYSA-N
MW250.33 g/mol
LogP1.49
Rot. Bonds5

About [(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine

[(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine (PubChem CID 105254414) has the molecular formula C11H14N4OS and a molecular weight of 250.33 g/mol. Its IUPAC name is [(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine
PubChem CID105254414
Molecular FormulaC11H14N4OS
Molecular Weight250.33 g/mol
Exact Mass250.09
IUPAC Name[(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine
SMILESCCOc1cncc(C(NN)c2cscn2)c1
InChIInChI=1S/C11H14N4OS/c1-2-16-9-3-8(4-13-5-9)11(15-12)10-6-17-7-14-10/h3-7,11,15H,2,12H2,1H3
InChIKeyRJHJDAIEUNIOQO-UHFFFAOYSA-N
XLogP1.49
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.33
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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 [(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine?
The IUPAC name of [(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine (CID 105254414) is [(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine is CCOc1cncc(C(NN)c2cscn2)c1.
What is the InChIKey of [(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine?
The InChIKey is RJHJDAIEUNIOQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4OS/c1-2-16-9-3-8(4-13-5-9)11(15-12)10-6-17-7-14-10/h3-7,11,15H,2,12H2,1H3.
What are the key properties of [(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine?
[(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine has a molecular weight of 250.33 g/mol, XLogP of 1.49, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 105254414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).