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

C7H9F4N3OS — CID 79764415

IUPAC[5-(2,2,3,3-tetrafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(COCC(F)(F)C(F)F)s1
InChIInChI=1S/C7H9F4N3OS/c8-5(9)7(10,11)3-15-2-4-1-13-6(14-12)16-4/h1,5H,2-3,12H2,(H,13,14)
InChIKeyRGQOCTDPUJVRSO-UHFFFAOYSA-N
MW259.23 g/mol
LogP1.85
Rot. Bonds6

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

[5-(2,2,3,3-tetrafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine (PubChem CID 79764415) has the molecular formula C7H9F4N3OS and a molecular weight of 259.23 g/mol. Its IUPAC name is [5-(2,2,3,3-tetrafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-(2,2,3,3-tetrafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine
PubChem CID79764415
Molecular FormulaC7H9F4N3OS
Molecular Weight259.23 g/mol
Exact Mass259.04
IUPAC Name[5-(2,2,3,3-tetrafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(COCC(F)(F)C(F)F)s1
InChIInChI=1S/C7H9F4N3OS/c8-5(9)7(10,11)3-15-2-4-1-13-6(14-12)16-4/h1,5H,2-3,12H2,(H,13,14)
InChIKeyRGQOCTDPUJVRSO-UHFFFAOYSA-N
XLogP1.85
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.23
LogP ≤ 51.85
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-tetrafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [5-(2,2,3,3-tetrafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine (CID 79764415) is [5-(2,2,3,3-tetrafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [5-(2,2,3,3-tetrafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [5-(2,2,3,3-tetrafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine is NNc1ncc(COCC(F)(F)C(F)F)s1.
What is the InChIKey of [5-(2,2,3,3-tetrafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine?
The InChIKey is RGQOCTDPUJVRSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F4N3OS/c8-5(9)7(10,11)3-15-2-4-1-13-6(14-12)16-4/h1,5H,2-3,12H2,(H,13,14).
What are the key properties of [5-(2,2,3,3-tetrafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine?
[5-(2,2,3,3-tetrafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine has a molecular weight of 259.23 g/mol, XLogP of 1.85, 6 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-tetrafluoropropoxymethyl)-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 79764415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).