[2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine

C14H16F3N3S — CID 106787337

IUPAC[2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine
SMILESCCC(c1ccccc1)C(NN)c1cnc(C(F)(F)F)s1
InChIInChI=1S/C14H16F3N3S/c1-2-10(9-6-4-3-5-7-9)12(20-18)11-8-19-13(21-11)14(15,16)17/h3-8,10,12,20H,2,18H2,1H3
InChIKeyNGVIMTPLRARFPF-UHFFFAOYSA-N
MW315.36 g/mol
LogP3.86
Rot. Bonds5

About [2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine

[2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine (PubChem CID 106787337) has the molecular formula C14H16F3N3S and a molecular weight of 315.36 g/mol. Its IUPAC name is [2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine.

Molecular Properties

Compound Name[2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine
PubChem CID106787337
Molecular FormulaC14H16F3N3S
Molecular Weight315.36 g/mol
Exact Mass315.10
IUPAC Name[2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine
SMILESCCC(c1ccccc1)C(NN)c1cnc(C(F)(F)F)s1
InChIInChI=1S/C14H16F3N3S/c1-2-10(9-6-4-3-5-7-9)12(20-18)11-8-19-13(21-11)14(15,16)17/h3-8,10,12,20H,2,18H2,1H3
InChIKeyNGVIMTPLRARFPF-UHFFFAOYSA-N
XLogP3.86
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.36
LogP ≤ 53.86
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-[2-(trifluoromethyl)-1,3-thiazol-5-yl]ethylhydrazine
CID 106786712
[pyridin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine
CID 106786696
N-ethyl-2,2-difluoro-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]ethanamine
CID 106785042
(2-phenyl-1-pyrazin-2-ylbutyl)hydrazine
CID 105308706
N-ethyl-2,3-dimethyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butan-1-amine
CID 106785855
[2-ethoxy-2-methyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]propyl]hydrazine
CID 106787056
[(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine
CID 106786785
N,2-diethyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]hexan-1-amine
CID 106785645
[2,3-dihydro-1H-inden-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine
CID 106786856
1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butane-1,2-diol
CID 106782928
[(4-methyl-2-pyridinyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine
CID 106786798
[(2,3-dimethylphenyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine
CID 106787343

Frequently Asked Questions

What is the IUPAC name of [2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine?
The IUPAC name of [2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine (CID 106787337) is [2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine.
What is the SMILES notation for [2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine?
The canonical SMILES for [2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine is CCC(c1ccccc1)C(NN)c1cnc(C(F)(F)F)s1.
What is the InChIKey of [2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine?
The InChIKey is NGVIMTPLRARFPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F3N3S/c1-2-10(9-6-4-3-5-7-9)12(20-18)11-8-19-13(21-11)14(15,16)17/h3-8,10,12,20H,2,18H2,1H3.
What are the key properties of [2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine?
[2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine has a molecular weight of 315.36 g/mol, XLogP of 3.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine is sourced from PubChem (CID 106787337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).