[2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine

C12H10ClF3N2S — CID 105208199

IUPAC[2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Cl)s1)c1cc(F)c(F)c(F)c1
InChIInChI=1S/C12H10ClF3N2S/c13-11-2-1-7(19-11)5-10(18-17)6-3-8(14)12(16)9(15)4-6/h1-4,10,18H,5,17H2
InChIKeyBIMZZJIMRZKAGW-UHFFFAOYSA-N
MW306.74 g/mol
LogP3.57
Rot. Bonds4

About [2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine

[2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine (PubChem CID 105208199) has the molecular formula C12H10ClF3N2S and a molecular weight of 306.74 g/mol. Its IUPAC name is [2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine
PubChem CID105208199
Molecular FormulaC12H10ClF3N2S
Molecular Weight306.74 g/mol
Exact Mass306.02
IUPAC Name[2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Cl)s1)c1cc(F)c(F)c(F)c1
InChIInChI=1S/C12H10ClF3N2S/c13-11-2-1-7(19-11)5-10(18-17)6-3-8(14)12(16)9(15)4-6/h1-4,10,18H,5,17H2
InChIKeyBIMZZJIMRZKAGW-UHFFFAOYSA-N
XLogP3.57
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.74
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[2-(5-chlorothiophen-2-yl)-1-(3,5-dibromophenyl)ethyl]hydrazine
CID 107978997
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CID 105217959
[2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine
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[2-(5-chlorothiophen-2-yl)-1-(furan-3-yl)ethyl]hydrazine
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[2-(5-chlorothiophen-2-yl)-1-(3-iodophenyl)ethyl]hydrazine
CID 105295870
[2-(1,3-thiazol-5-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine
CID 105208069
1-(5-chloro-2-fluorophenyl)-2-(5-chlorothiophen-2-yl)-N-methylethanamine
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[2-(5-chlorothiophen-2-yl)-1-(3-propan-2-yloxyphenyl)ethyl]hydrazine
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[2-(5-chlorothiophen-2-yl)-1-thiophen-2-ylethyl]hydrazine
CID 105193742
[1-(5-chloro-2-pyridinyl)-2-(5-chlorothiophen-2-yl)ethyl]hydrazine
CID 105251592
[1-(3,4-difluorophenyl)-2-(5-ethylthiophen-2-yl)ethyl]hydrazine
CID 105197122
[2-(5-chlorothiophen-2-yl)-1-(5-methylfuran-2-yl)ethyl]hydrazine
CID 105295997

Frequently Asked Questions

What is the IUPAC name of [2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine?
The IUPAC name of [2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine (CID 105208199) is [2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine?
The canonical SMILES for [2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine is NNC(Cc1ccc(Cl)s1)c1cc(F)c(F)c(F)c1.
What is the InChIKey of [2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine?
The InChIKey is BIMZZJIMRZKAGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClF3N2S/c13-11-2-1-7(19-11)5-10(18-17)6-3-8(14)12(16)9(15)4-6/h1-4,10,18H,5,17H2.
What are the key properties of [2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine?
[2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine has a molecular weight of 306.74 g/mol, XLogP of 3.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105208199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).