[5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine

C7H8F5N3OS — CID 79764569

IUPAC[5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(COCC(F)(F)C(F)(F)F)s1
InChIInChI=1S/C7H8F5N3OS/c8-6(9,7(10,11)12)3-16-2-4-1-14-5(15-13)17-4/h1H,2-3,13H2,(H,14,15)
InChIKeyJLPAMGUNMDUXHU-UHFFFAOYSA-N
MW277.22 g/mol
LogP2.14
Rot. Bonds5

About [5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine

[5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine (PubChem CID 79764569) has the molecular formula C7H8F5N3OS and a molecular weight of 277.22 g/mol. Its IUPAC name is [5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine
PubChem CID79764569
Molecular FormulaC7H8F5N3OS
Molecular Weight277.22 g/mol
Exact Mass277.03
IUPAC Name[5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(COCC(F)(F)C(F)(F)F)s1
InChIInChI=1S/C7H8F5N3OS/c8-6(9,7(10,11)12)3-16-2-4-1-14-5(15-13)17-4/h1H,2-3,13H2,(H,14,15)
InChIKeyJLPAMGUNMDUXHU-UHFFFAOYSA-N
XLogP2.14
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.22
LogP ≤ 52.14
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'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine (CID 79764569) is [5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine is NNc1ncc(COCC(F)(F)C(F)(F)F)s1.
What is the InChIKey of [5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine?
The InChIKey is JLPAMGUNMDUXHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F5N3OS/c8-6(9,7(10,11)12)3-16-2-4-1-14-5(15-13)17-4/h1H,2-3,13H2,(H,14,15).
What are the key properties of [5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine?
[5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine has a molecular weight of 277.22 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2,2,3,3,3-pentafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 79764569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).