[1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine

C15H18N4S — CID 105291375

IUPAC[1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
SMILESCCn1cc(CC(NN)c2csc3ccccc23)cn1
InChIInChI=1S/C15H18N4S/c1-2-19-9-11(8-17-19)7-14(18-16)13-10-20-15-6-4-3-5-12(13)15/h3-6,8-10,14,18H,2,7,16H2,1H3
InChIKeyRHMXACDKAFKNQG-UHFFFAOYSA-N
MW286.40 g/mol
LogP2.86
Rot. Bonds5

About [1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine

[1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine (PubChem CID 105291375) has the molecular formula C15H18N4S and a molecular weight of 286.40 g/mol. Its IUPAC name is [1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
PubChem CID105291375
Molecular FormulaC15H18N4S
Molecular Weight286.40 g/mol
Exact Mass286.13
IUPAC Name[1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
SMILESCCn1cc(CC(NN)c2csc3ccccc23)cn1
InChIInChI=1S/C15H18N4S/c1-2-19-9-11(8-17-19)7-14(18-16)13-10-20-15-6-4-3-5-12(13)15/h3-6,8-10,14,18H,2,7,16H2,1H3
InChIKeyRHMXACDKAFKNQG-UHFFFAOYSA-N
XLogP2.86
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 52.86
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

1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethanol
CID 63893599
[1-(2,3-dimethylphenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
CID 105291272
[1-(1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine
CID 105286405
[1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
CID 105291385
[1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
CID 105291296
[1-(1-benzothiophen-3-yl)-2-ethoxyethyl]hydrazine
CID 105321248
[2-(1-ethylpyrazol-4-yl)-1-(thiadiazol-4-yl)ethyl]hydrazine
CID 105291319
2-(1-ethylpyrazol-4-yl)-N-methyl-1-thiophen-2-ylethanamine
CID 62127681
[1-(1-benzothiophen-3-yl)-3-methylhexyl]hydrazine
CID 105298182
[1-benzothiophen-3-yl-(4-bromo-1-ethylpyrazol-5-yl)methyl]hydrazine
CID 105336177
[1-(1-benzothiophen-3-yl)-3-methylbut-3-enyl]hydrazine
CID 105319578
1-(1-benzothiophen-3-yl)but-3-enylhydrazine
CID 105289618

Frequently Asked Questions

What is the IUPAC name of [1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine?
The IUPAC name of [1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine (CID 105291375) is [1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine is CCn1cc(CC(NN)c2csc3ccccc23)cn1.
What is the InChIKey of [1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine?
The InChIKey is RHMXACDKAFKNQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4S/c1-2-19-9-11(8-17-19)7-14(18-16)13-10-20-15-6-4-3-5-12(13)15/h3-6,8-10,14,18H,2,7,16H2,1H3.
What are the key properties of [1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine?
[1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine has a molecular weight of 286.40 g/mol, XLogP of 2.86, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105291375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).