[5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine

C10H15F3N4S — CID 79765285

IUPAC[5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(CN2CCCC(C(F)(F)F)C2)s1
InChIInChI=1S/C10H15F3N4S/c11-10(12,13)7-2-1-3-17(5-7)6-8-4-15-9(16-14)18-8/h4,7H,1-3,5-6,14H2,(H,15,16)
InChIKeySLTXDZJHMDVVJZ-UHFFFAOYSA-N
MW280.32 g/mol
LogP2.20
Rot. Bonds3

About [5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine

[5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine (PubChem CID 79765285) has the molecular formula C10H15F3N4S and a molecular weight of 280.32 g/mol. Its IUPAC name is [5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine
PubChem CID79765285
Molecular FormulaC10H15F3N4S
Molecular Weight280.32 g/mol
Exact Mass280.10
IUPAC Name[5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(CN2CCCC(C(F)(F)F)C2)s1
InChIInChI=1S/C10H15F3N4S/c11-10(12,13)7-2-1-3-17(5-7)6-8-4-15-9(16-14)18-8/h4,7H,1-3,5-6,14H2,(H,15,16)
InChIKeySLTXDZJHMDVVJZ-UHFFFAOYSA-N
XLogP2.20
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 52.20
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'}

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Frequently Asked Questions

What is the IUPAC name of [5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine (CID 79765285) is [5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine is NNc1ncc(CN2CCCC(C(F)(F)F)C2)s1.
What is the InChIKey of [5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine?
The InChIKey is SLTXDZJHMDVVJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F3N4S/c11-10(12,13)7-2-1-3-17(5-7)6-8-4-15-9(16-14)18-8/h4,7H,1-3,5-6,14H2,(H,15,16).
What are the key properties of [5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine?
[5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine has a molecular weight of 280.32 g/mol, XLogP of 2.20, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 79765285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).