[1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine

C10H13BrN4S — CID 105222106

IUPAC[1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
SMILESCn1ccc(CC(NN)c2ccc(Br)s2)n1
InChIInChI=1S/C10H13BrN4S/c1-15-5-4-7(14-15)6-8(13-12)9-2-3-10(11)16-9/h2-5,8,13H,6,12H2,1H3
InChIKeyVGVBRQDVGQZQIT-UHFFFAOYSA-N
MW301.21 g/mol
LogP1.99
Rot. Bonds4

About [1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine

[1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine (PubChem CID 105222106) has the molecular formula C10H13BrN4S and a molecular weight of 301.21 g/mol. Its IUPAC name is [1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
PubChem CID105222106
Molecular FormulaC10H13BrN4S
Molecular Weight301.21 g/mol
Exact Mass300.00
IUPAC Name[1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
SMILESCn1ccc(CC(NN)c2ccc(Br)s2)n1
InChIInChI=1S/C10H13BrN4S/c1-15-5-4-7(14-15)6-8(13-12)9-2-3-10(11)16-9/h2-5,8,13H,6,12H2,1H3
InChIKeyVGVBRQDVGQZQIT-UHFFFAOYSA-N
XLogP1.99
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.21
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-(5-methylthiophen-2-yl)ethyl]hydrazine
CID 105329473
[1-(5-ethylthiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105329455
[1-(5-bromothiophen-2-yl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
CID 107066094
[1-(2-bromophenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105208608
[2-(1-methylpyrazol-3-yl)-1-phenylethyl]hydrazine
CID 105199243
[1-(5-bromo-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105267716
[1-(2-bromo-4-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105329498
[1-(4-bromo-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105329446
1-(5-bromothiophen-2-yl)propylhydrazine
CID 105222163
[1-(5-bromothiophen-2-yl)-2-(1-methylindazol-3-yl)ethyl]hydrazine
CID 105222148
[2-(1-methylpyrazol-3-yl)-1-pyrimidin-5-ylethyl]hydrazine
CID 102924279
[2-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine
CID 105329598

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine?
The IUPAC name of [1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine (CID 105222106) is [1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine is Cn1ccc(CC(NN)c2ccc(Br)s2)n1.
What is the InChIKey of [1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine?
The InChIKey is VGVBRQDVGQZQIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN4S/c1-15-5-4-7(14-15)6-8(13-12)9-2-3-10(11)16-9/h2-5,8,13H,6,12H2,1H3.
What are the key properties of [1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine?
[1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine has a molecular weight of 301.21 g/mol, XLogP of 1.99, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromothiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105222106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).