[(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine

C11H12F3N5S — CID 102710567

IUPAC[(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
SMILESCCc1nnsc1C(NN)c1cnccc1C(F)(F)F
InChIInChI=1S/C11H12F3N5S/c1-2-8-10(20-19-18-8)9(17-15)6-5-16-4-3-7(6)11(12,13)14/h3-5,9,17H,2,15H2,1H3
InChIKeyHABJPDRHHKCWSF-UHFFFAOYSA-N
MW303.31 g/mol
LogP2.07
Rot. Bonds4

About [(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine

[(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine (PubChem CID 102710567) has the molecular formula C11H12F3N5S and a molecular weight of 303.31 g/mol. Its IUPAC name is [(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine.

Molecular Properties

Compound Name[(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
PubChem CID102710567
Molecular FormulaC11H12F3N5S
Molecular Weight303.31 g/mol
Exact Mass303.08
IUPAC Name[(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
SMILESCCc1nnsc1C(NN)c1cnccc1C(F)(F)F
InChIInChI=1S/C11H12F3N5S/c1-2-8-10(20-19-18-8)9(17-15)6-5-16-4-3-7(6)11(12,13)14/h3-5,9,17H,2,15H2,1H3
InChIKeyHABJPDRHHKCWSF-UHFFFAOYSA-N
XLogP2.07
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.31
LogP ≤ 52.07
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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Related Compounds

(4-propylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanamine
CID 102709870
[(4-ethylthiadiazol-5-yl)-pyrazin-2-ylmethyl]hydrazine
CID 105308737
(4-ethylthiadiazol-5-yl)-[2-(trifluoromethyl)phenyl]methanamine
CID 105145381
N-[(4-ethylthiadiazol-5-yl)-(4-methyl-3-pyridinyl)methyl]propan-1-amine
CID 105164387
[2-methylsulfanyl-1-[4-(trifluoromethyl)-3-pyridinyl]ethyl]hydrazine
CID 102710309
[(4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 105318787
[(4-ethylthiadiazol-5-yl)-(furan-3-yl)methyl]hydrazine
CID 105305908
[(1-ethylimidazol-2-yl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
CID 105308543
[(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
CID 105301889
[3-methylsulfanyl-1-[4-(trifluoromethyl)-3-pyridinyl]propyl]hydrazine
CID 102710527
[(3,4-dimethylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
CID 102710524
[(2-iodophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
CID 102710449

Frequently Asked Questions

What is the IUPAC name of [(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine?
The IUPAC name of [(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine (CID 102710567) is [(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine.
What is the SMILES notation for [(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine?
The canonical SMILES for [(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine is CCc1nnsc1C(NN)c1cnccc1C(F)(F)F.
What is the InChIKey of [(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine?
The InChIKey is HABJPDRHHKCWSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F3N5S/c1-2-8-10(20-19-18-8)9(17-15)6-5-16-4-3-7(6)11(12,13)14/h3-5,9,17H,2,15H2,1H3.
What are the key properties of [(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine?
[(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine has a molecular weight of 303.31 g/mol, XLogP of 2.07, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine is sourced from PubChem (CID 102710567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).