[1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine

C12H20N2OS — CID 105198543

IUPAC[1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine
SMILESNNC(CCc1cccs1)CC1CCCO1
InChIInChI=1S/C12H20N2OS/c13-14-10(9-11-3-1-7-15-11)5-6-12-4-2-8-16-12/h2,4,8,10-11,14H,1,3,5-7,9,13H2
InChIKeyJGMLXTGPIWYIRF-UHFFFAOYSA-N
MW240.37 g/mol
LogP2.08
Rot. Bonds6

About [1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine

[1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine (PubChem CID 105198543) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is [1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine
PubChem CID105198543
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC Name[1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine
SMILESNNC(CCc1cccs1)CC1CCCO1
InChIInChI=1S/C12H20N2OS/c13-14-10(9-11-3-1-7-15-11)5-6-12-4-2-8-16-12/h2,4,8,10-11,14H,1,3,5-7,9,13H2
InChIKeyJGMLXTGPIWYIRF-UHFFFAOYSA-N
XLogP2.08
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 52.08
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 [1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine?
The IUPAC name of [1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine (CID 105198543) is [1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine.
What is the SMILES notation for [1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine?
The canonical SMILES for [1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine is NNC(CCc1cccs1)CC1CCCO1.
What is the InChIKey of [1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine?
The InChIKey is JGMLXTGPIWYIRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c13-14-10(9-11-3-1-7-15-11)5-6-12-4-2-8-16-12/h2,4,8,10-11,14H,1,3,5-7,9,13H2.
What are the key properties of [1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine?
[1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine has a molecular weight of 240.37 g/mol, XLogP of 2.08, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine is sourced from PubChem (CID 105198543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).