[5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine

C9H14F3N3S — CID 105328896

IUPAC[5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine
SMILESCc1ncsc1C(CCCC(F)(F)F)NN
InChIInChI=1S/C9H14F3N3S/c1-6-8(16-5-14-6)7(15-13)3-2-4-9(10,11)12/h5,7,15H,2-4,13H2,1H3
InChIKeyPWQQPIYNLKMYDZ-UHFFFAOYSA-N
MW253.29 g/mol
LogP2.69
Rot. Bonds5

About [5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine

[5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine (PubChem CID 105328896) has the molecular formula C9H14F3N3S and a molecular weight of 253.29 g/mol. Its IUPAC name is [5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine.

Molecular Properties

Compound Name[5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine
PubChem CID105328896
Molecular FormulaC9H14F3N3S
Molecular Weight253.29 g/mol
Exact Mass253.09
IUPAC Name[5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine
SMILESCc1ncsc1C(CCCC(F)(F)F)NN
InChIInChI=1S/C9H14F3N3S/c1-6-8(16-5-14-6)7(15-13)3-2-4-9(10,11)12/h5,7,15H,2-4,13H2,1H3
InChIKeyPWQQPIYNLKMYDZ-UHFFFAOYSA-N
XLogP2.69
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.29
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(4-methyl-1,3-thiazol-5-yl)pentylhydrazine
CID 105293729
[1-(4-methyl-1,3-thiazol-5-yl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105314053
N,4,4-trimethyl-1-(4-methyl-1,3-thiazol-5-yl)pentan-1-amine
CID 105140195
N-methyl-1-(4-methyl-1,3-thiazol-5-yl)undecan-1-amine
CID 105138249
N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)pentan-1-amine
CID 105125558
N-ethyl-5,5,5-trifluoro-1-(1,3-thiazol-5-yl)pentan-1-amine
CID 115517469
[2-(2-methyl-1,3-thiazol-4-yl)-1-(4-methyl-1,3-thiazol-5-yl)ethyl]hydrazine
CID 105316113
[2-(1-methylimidazol-2-yl)-1-(4-methyl-1,3-thiazol-5-yl)ethyl]hydrazine
CID 105322886
5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol
CID 105122728
[1-(2,4-difluoro-5-methylphenyl)-5,5,5-trifluoropentyl]hydrazine
CID 105329005
1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol
CID 105085734
1-(4-methyl-1,3-thiazol-5-yl)-2-(trifluoromethyl)prop-2-en-1-amine
CID 130565104

Frequently Asked Questions

What is the IUPAC name of [5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine?
The IUPAC name of [5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine (CID 105328896) is [5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine.
What is the SMILES notation for [5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine?
The canonical SMILES for [5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine is Cc1ncsc1C(CCCC(F)(F)F)NN.
What is the InChIKey of [5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine?
The InChIKey is PWQQPIYNLKMYDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14F3N3S/c1-6-8(16-5-14-6)7(15-13)3-2-4-9(10,11)12/h5,7,15H,2-4,13H2,1H3.
What are the key properties of [5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine?
[5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine has a molecular weight of 253.29 g/mol, XLogP of 2.69, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine is sourced from PubChem (CID 105328896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).