[1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine

C11H18N2OS — CID 105211809

IUPAC[1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine
SMILESNNC(Cc1cccs1)C1CCOCC1
InChIInChI=1S/C11H18N2OS/c12-13-11(8-10-2-1-7-15-10)9-3-5-14-6-4-9/h1-2,7,9,11,13H,3-6,8,12H2
InChIKeyFFRUCIQHCOBAMW-UHFFFAOYSA-N
MW226.34 g/mol
LogP1.55
Rot. Bonds4

About [1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine

[1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine (PubChem CID 105211809) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is [1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine.

Molecular Properties

Compound Name[1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine
PubChem CID105211809
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC Name[1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine
SMILESNNC(Cc1cccs1)C1CCOCC1
InChIInChI=1S/C11H18N2OS/c12-13-11(8-10-2-1-7-15-10)9-3-5-14-6-4-9/h1-2,7,9,11,13H,3-6,8,12H2
InChIKeyFFRUCIQHCOBAMW-UHFFFAOYSA-N
XLogP1.55
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 51.55
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-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine?
The IUPAC name of [1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine (CID 105211809) is [1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine.
What is the SMILES notation for [1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine?
The canonical SMILES for [1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine is NNC(Cc1cccs1)C1CCOCC1.
What is the InChIKey of [1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine?
The InChIKey is FFRUCIQHCOBAMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c12-13-11(8-10-2-1-7-15-10)9-3-5-14-6-4-9/h1-2,7,9,11,13H,3-6,8,12H2.
What are the key properties of [1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine?
[1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine has a molecular weight of 226.34 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine is sourced from PubChem (CID 105211809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).