[2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine

C12H14BrN3S — CID 105334611

IUPAC[2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine
SMILESCc1ccsc1C(Cc1ccc(Br)cn1)NN
InChIInChI=1S/C12H14BrN3S/c1-8-4-5-17-12(8)11(16-14)6-10-3-2-9(13)7-15-10/h2-5,7,11,16H,6,14H2,1H3
InChIKeySELBQRJTIFECLL-UHFFFAOYSA-N
MW312.24 g/mol
LogP2.96
Rot. Bonds4

About [2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine

[2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine (PubChem CID 105334611) has the molecular formula C12H14BrN3S and a molecular weight of 312.24 g/mol. Its IUPAC name is [2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine
PubChem CID105334611
Molecular FormulaC12H14BrN3S
Molecular Weight312.24 g/mol
Exact Mass311.01
IUPAC Name[2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine
SMILESCc1ccsc1C(Cc1ccc(Br)cn1)NN
InChIInChI=1S/C12H14BrN3S/c1-8-4-5-17-12(8)11(16-14)6-10-3-2-9(13)7-15-10/h2-5,7,11,16H,6,14H2,1H3
InChIKeySELBQRJTIFECLL-UHFFFAOYSA-N
XLogP2.96
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.24
LogP ≤ 52.96
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-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine
CID 105329598
[2-(5-bromo-2-pyridinyl)-1-(2,4-difluoro-5-methylphenyl)ethyl]hydrazine
CID 105334604
N-[2-(5-bromo-2-pyridinyl)-1-(3-bromothiophen-2-yl)ethyl]propan-1-amine
CID 105036190
[2-(2-bromophenyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine
CID 105214945
[2-(5-bromo-2-pyridinyl)-1-(thiadiazol-5-yl)ethyl]hydrazine
CID 105334474
[1-(5-bromo-2-pyridinyl)-3-methylbutan-2-yl]hydrazine
CID 105199530
[1-(5-bromo-2-pyridinyl)-2-(5-ethyl-2-pyridinyl)ethyl]hydrazine
CID 105267672
[2-(1-methylimidazol-2-yl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine
CID 105323002
[2-(5-bromo-2-pyridinyl)-1-(1H-1,2,4-triazol-5-yl)ethyl]hydrazine
CID 105230433
[2-(5-bromo-2-pyridinyl)-1-(5-ethylfuran-2-yl)ethyl]hydrazine
CID 105334600
[2-(4-iodophenyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine
CID 105310356
[2-(2-chloro-4-methylphenyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine
CID 106868593

Frequently Asked Questions

What is the IUPAC name of [2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine (CID 105334611) is [2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine is Cc1ccsc1C(Cc1ccc(Br)cn1)NN.
What is the InChIKey of [2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine?
The InChIKey is SELBQRJTIFECLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrN3S/c1-8-4-5-17-12(8)11(16-14)6-10-3-2-9(13)7-15-10/h2-5,7,11,16H,6,14H2,1H3.
What are the key properties of [2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine?
[2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine has a molecular weight of 312.24 g/mol, XLogP of 2.96, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-bromo-2-pyridinyl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105334611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).