[1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine

C14H15F3N2OS — CID 105296937

IUPAC[1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine
SMILESCc1ccsc1C(Cc1ccc(OC(F)(F)F)cc1)NN
InChIInChI=1S/C14H15F3N2OS/c1-9-6-7-21-13(9)12(19-18)8-10-2-4-11(5-3-10)20-14(15,16)17/h2-7,12,19H,8,18H2,1H3
InChIKeyUVMZJPOJLNHSEI-UHFFFAOYSA-N
MW316.35 g/mol
LogP3.70
Rot. Bonds5

About [1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine

[1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine (PubChem CID 105296937) has the molecular formula C14H15F3N2OS and a molecular weight of 316.35 g/mol. Its IUPAC name is [1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine
PubChem CID105296937
Molecular FormulaC14H15F3N2OS
Molecular Weight316.35 g/mol
Exact Mass316.09
IUPAC Name[1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine
SMILESCc1ccsc1C(Cc1ccc(OC(F)(F)F)cc1)NN
InChIInChI=1S/C14H15F3N2OS/c1-9-6-7-21-13(9)12(19-18)8-10-2-4-11(5-3-10)20-14(15,16)17/h2-7,12,19H,8,18H2,1H3
InChIKeyUVMZJPOJLNHSEI-UHFFFAOYSA-N
XLogP3.70
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.35
LogP ≤ 53.70
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-(3-chlorothiophen-2-yl)-N-methyl-2-[4-(trifluoromethoxy)phenyl]ethanamine
CID 115843408
[1-(5-iodothiophen-3-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine
CID 105296941
[1-(3-bromothiophen-2-yl)-2-(4-methoxyphenyl)ethyl]hydrazine
CID 105205541
[3,3-dimethyl-1-[4-(trifluoromethoxy)phenyl]pentan-2-yl]hydrazine
CID 105296950
[1-(1H-1,2,4-triazol-5-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine
CID 105230325
N-methyl-1-thiophen-3-yl-2-[4-(trifluoromethoxy)phenyl]ethanamine
CID 62601116
[1-(1-methylcyclopentyl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine
CID 105296915
[2-(1-methylimidazol-2-yl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine
CID 105323002
[2-thiophen-2-yl-1-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine
CID 105295517
[4-methoxy-4-methyl-1-[4-(trifluoromethoxy)phenyl]pentan-2-yl]hydrazine
CID 103025250
[1-(3-ethylthiophen-2-yl)-2-(4-iodophenyl)ethyl]hydrazine
CID 105310241
[2-(2-bromophenyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine
CID 105214945

Frequently Asked Questions

What is the IUPAC name of [1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine?
The IUPAC name of [1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine (CID 105296937) is [1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine.
What is the SMILES notation for [1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine?
The canonical SMILES for [1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine is Cc1ccsc1C(Cc1ccc(OC(F)(F)F)cc1)NN.
What is the InChIKey of [1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine?
The InChIKey is UVMZJPOJLNHSEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F3N2OS/c1-9-6-7-21-13(9)12(19-18)8-10-2-4-11(5-3-10)20-14(15,16)17/h2-7,12,19H,8,18H2,1H3.
What are the key properties of [1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine?
[1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine has a molecular weight of 316.35 g/mol, XLogP of 3.70, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-methylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethyl]hydrazine is sourced from PubChem (CID 105296937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).