[5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine

C10H16F3N5S — CID 79765409

IUPAC[5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(CN2CCN(CC(F)(F)F)CC2)s1
InChIInChI=1S/C10H16F3N5S/c11-10(12,13)7-18-3-1-17(2-4-18)6-8-5-15-9(16-14)19-8/h5H,1-4,6-7,14H2,(H,15,16)
InChIKeyWLYJQHQFKHKTTK-UHFFFAOYSA-N
MW295.33 g/mol
LogP1.11
Rot. Bonds4

About [5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine

[5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine (PubChem CID 79765409) has the molecular formula C10H16F3N5S and a molecular weight of 295.33 g/mol. Its IUPAC name is [5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine
PubChem CID79765409
Molecular FormulaC10H16F3N5S
Molecular Weight295.33 g/mol
Exact Mass295.11
IUPAC Name[5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(CN2CCN(CC(F)(F)F)CC2)s1
InChIInChI=1S/C10H16F3N5S/c11-10(12,13)7-18-3-1-17(2-4-18)6-8-5-15-9(16-14)19-8/h5H,1-4,6-7,14H2,(H,15,16)
InChIKeyWLYJQHQFKHKTTK-UHFFFAOYSA-N
XLogP1.11
TPSA57.42 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.33
LogP ≤ 51.11
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-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine (CID 79765409) is [5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine is NNc1ncc(CN2CCN(CC(F)(F)F)CC2)s1.
What is the InChIKey of [5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine?
The InChIKey is WLYJQHQFKHKTTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3N5S/c11-10(12,13)7-18-3-1-17(2-4-18)6-8-5-15-9(16-14)19-8/h5H,1-4,6-7,14H2,(H,15,16).
What are the key properties of [5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine?
[5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine has a molecular weight of 295.33 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 79765409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).