[2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine

C11H11BrFN3S — CID 105248249

IUPAC[2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Br)s1)c1ccc(F)cn1
InChIInChI=1S/C11H11BrFN3S/c12-11-4-2-8(17-11)5-10(16-14)9-3-1-7(13)6-15-9/h1-4,6,10,16H,5,14H2
InChIKeyBFIUSLPWVNAKMV-UHFFFAOYSA-N
MW316.20 g/mol
LogP2.79
Rot. Bonds4

About [2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine

[2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine (PubChem CID 105248249) has the molecular formula C11H11BrFN3S and a molecular weight of 316.20 g/mol. Its IUPAC name is [2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine
PubChem CID105248249
Molecular FormulaC11H11BrFN3S
Molecular Weight316.20 g/mol
Exact Mass314.98
IUPAC Name[2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Br)s1)c1ccc(F)cn1
InChIInChI=1S/C11H11BrFN3S/c12-11-4-2-8(17-11)5-10(16-14)9-3-1-7(13)6-15-9/h1-4,6,10,16H,5,14H2
InChIKeyBFIUSLPWVNAKMV-UHFFFAOYSA-N
XLogP2.79
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.20
LogP ≤ 52.79
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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Frequently Asked Questions

What is the IUPAC name of [2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine (CID 105248249) is [2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine is NNC(Cc1ccc(Br)s1)c1ccc(F)cn1.
What is the InChIKey of [2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine?
The InChIKey is BFIUSLPWVNAKMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrFN3S/c12-11-4-2-8(17-11)5-10(16-14)9-3-1-7(13)6-15-9/h1-4,6,10,16H,5,14H2.
What are the key properties of [2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine?
[2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine has a molecular weight of 316.20 g/mol, XLogP of 2.79, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105248249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).