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

C11H11F3N4S — CID 106786798

IUPAC[(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine
SMILESCc1ccnc(C(NN)c2cnc(C(F)(F)F)s2)c1
InChIInChI=1S/C11H11F3N4S/c1-6-2-3-16-7(4-6)9(18-15)8-5-17-10(19-8)11(12,13)14/h2-5,9,18H,15H2,1H3
InChIKeyVLBRYIQAWCNCHR-UHFFFAOYSA-N
MW288.30 g/mol
LogP2.42
Rot. Bonds3

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

[(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine (PubChem CID 106786798) has the molecular formula C11H11F3N4S and a molecular weight of 288.30 g/mol. Its IUPAC name is [(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine.

Molecular Properties

Compound Name[(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine
PubChem CID106786798
Molecular FormulaC11H11F3N4S
Molecular Weight288.30 g/mol
Exact Mass288.07
IUPAC Name[(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine
SMILESCc1ccnc(C(NN)c2cnc(C(F)(F)F)s2)c1
InChIInChI=1S/C11H11F3N4S/c1-6-2-3-16-7(4-6)9(18-15)8-5-17-10(19-8)11(12,13)14/h2-5,9,18H,15H2,1H3
InChIKeyVLBRYIQAWCNCHR-UHFFFAOYSA-N
XLogP2.42
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.30
LogP ≤ 52.42
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 [(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine?
The IUPAC name of [(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine (CID 106786798) is [(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine.
What is the SMILES notation for [(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine?
The canonical SMILES for [(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine is Cc1ccnc(C(NN)c2cnc(C(F)(F)F)s2)c1.
What is the InChIKey of [(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine?
The InChIKey is VLBRYIQAWCNCHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N4S/c1-6-2-3-16-7(4-6)9(18-15)8-5-17-10(19-8)11(12,13)14/h2-5,9,18H,15H2,1H3.
What are the key properties of [(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine?
[(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine has a molecular weight of 288.30 g/mol, XLogP of 2.42, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine is sourced from PubChem (CID 106786798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).