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

C14H14F3N3S — CID 106786785

IUPAC[(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine
SMILESNNC(c1cnc(C(F)(F)F)s1)C1(c2ccccc2)CC1
InChIInChI=1S/C14H14F3N3S/c15-14(16,17)12-19-8-10(21-12)11(20-18)13(6-7-13)9-4-2-1-3-5-9/h1-5,8,11,20H,6-7,18H2
InChIKeyBDEKBXSTTBIUMA-UHFFFAOYSA-N
MW313.35 g/mol
LogP3.40
Rot. Bonds4

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

[(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine (PubChem CID 106786785) has the molecular formula C14H14F3N3S and a molecular weight of 313.35 g/mol. Its IUPAC name is [(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine.

Molecular Properties

Compound Name[(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine
PubChem CID106786785
Molecular FormulaC14H14F3N3S
Molecular Weight313.35 g/mol
Exact Mass313.09
IUPAC Name[(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine
SMILESNNC(c1cnc(C(F)(F)F)s1)C1(c2ccccc2)CC1
InChIInChI=1S/C14H14F3N3S/c15-14(16,17)12-19-8-10(21-12)11(20-18)13(6-7-13)9-4-2-1-3-5-9/h1-5,8,11,20H,6-7,18H2
InChIKeyBDEKBXSTTBIUMA-UHFFFAOYSA-N
XLogP3.40
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.35
LogP ≤ 53.40
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

[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]ethylhydrazine
CID 106786712
[(5-chlorothiophen-2-yl)-(1-phenylcyclohexyl)methyl]hydrazine
CID 105217569
[(2,6-difluorophenyl)-(1-phenylcyclopropyl)methyl]hydrazine
CID 105217060
[2-phenyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butyl]hydrazine
CID 106787337
[(2,3-dimethylphenyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine
CID 106787343
[(2-methoxypyrimidin-5-yl)-(1-phenylcyclopropyl)methyl]hydrazine
CID 112747730
[pyridin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine
CID 106786696
[(5-chlorothiophen-2-yl)-(4-phenyloxan-4-yl)methyl]hydrazine
CID 105217638
[(4-methyl-3-pyridinyl)-(1-phenylcyclopropyl)methyl]hydrazine
CID 105217138
[(5-methylthiophen-3-yl)-(1-phenylcyclopropyl)methyl]hydrazine
CID 105217208
N-[(1-methylcyclohexyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]ethanamine
CID 106830795

Frequently Asked Questions

What is the IUPAC name of [(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine?
The IUPAC name of [(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine (CID 106786785) is [(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine.
What is the SMILES notation for [(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine?
The canonical SMILES for [(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine is NNC(c1cnc(C(F)(F)F)s1)C1(c2ccccc2)CC1.
What is the InChIKey of [(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine?
The InChIKey is BDEKBXSTTBIUMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F3N3S/c15-14(16,17)12-19-8-10(21-12)11(20-18)13(6-7-13)9-4-2-1-3-5-9/h1-5,8,11,20H,6-7,18H2.
What are the key properties of [(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine?
[(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine has a molecular weight of 313.35 g/mol, XLogP of 3.40, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(1-phenylcyclopropyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]hydrazine is sourced from PubChem (CID 106786785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).