[2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine

C14H22N4OS — CID 105312638

IUPAC[2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine
SMILESCCC(C)n1ccc(CC(NN)c2sccc2OC)n1
InChIInChI=1S/C14H22N4OS/c1-4-10(2)18-7-5-11(17-18)9-12(16-15)14-13(19-3)6-8-20-14/h5-8,10,12,16H,4,9,15H2,1-3H3
InChIKeyABPKQHFYSZGSEH-UHFFFAOYSA-N
MW294.42 g/mol
LogP2.67
Rot. Bonds7

About [2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine

[2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine (PubChem CID 105312638) has the molecular formula C14H22N4OS and a molecular weight of 294.42 g/mol. Its IUPAC name is [2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine
PubChem CID105312638
Molecular FormulaC14H22N4OS
Molecular Weight294.42 g/mol
Exact Mass294.15
IUPAC Name[2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine
SMILESCCC(C)n1ccc(CC(NN)c2sccc2OC)n1
InChIInChI=1S/C14H22N4OS/c1-4-10(2)18-7-5-11(17-18)9-12(16-15)14-13(19-3)6-8-20-14/h5-8,10,12,16H,4,9,15H2,1-3H3
InChIKeyABPKQHFYSZGSEH-UHFFFAOYSA-N
XLogP2.67
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-butan-2-ylpyrazol-3-yl)-1-(3-chlorothiophen-2-yl)ethyl]hydrazine
CID 105312536
2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethanol
CID 115806434
1-(3-methoxythiophen-2-yl)propylhydrazine
CID 105281967
[1-(3-ethylthiophen-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
CID 105313402
[1-(5-bromothiophen-3-yl)-2-(1-butan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105312620
2-(1-butan-2-ylpyrazol-3-yl)-1-(3-ethylthiophen-2-yl)ethanamine
CID 104989680
[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine
CID 105316064
[2-(4-iodophenyl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine
CID 105310401
[2-(1-butan-2-ylpyrazol-3-yl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine
CID 102813123
[1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine
CID 105331419
[2-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine
CID 105329598
[1-(3-methoxythiophen-2-yl)-2-(2-methylphenyl)ethyl]hydrazine
CID 105285283

Frequently Asked Questions

What is the IUPAC name of [2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine (CID 105312638) is [2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine is CCC(C)n1ccc(CC(NN)c2sccc2OC)n1.
What is the InChIKey of [2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine?
The InChIKey is ABPKQHFYSZGSEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4OS/c1-4-10(2)18-7-5-11(17-18)9-12(16-15)14-13(19-3)6-8-20-14/h5-8,10,12,16H,4,9,15H2,1-3H3.
What are the key properties of [2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine?
[2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine has a molecular weight of 294.42 g/mol, XLogP of 2.67, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-butan-2-ylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105312638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).