[2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine

C12H22N2OS — CID 105271529

IUPAC[2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine
SMILESCCCC(OCC)C(NN)c1csc(C)c1
InChIInChI=1S/C12H22N2OS/c1-4-6-11(15-5-2)12(14-13)10-7-9(3)16-8-10/h7-8,11-12,14H,4-6,13H2,1-3H3
InChIKeySEYSBJDIZZZJFP-UHFFFAOYSA-N
MW242.39 g/mol
LogP2.77
Rot. Bonds7

About [2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine

[2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine (PubChem CID 105271529) has the molecular formula C12H22N2OS and a molecular weight of 242.39 g/mol. Its IUPAC name is [2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine.

Molecular Properties

Compound Name[2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine
PubChem CID105271529
Molecular FormulaC12H22N2OS
Molecular Weight242.39 g/mol
Exact Mass242.15
IUPAC Name[2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine
SMILESCCCC(OCC)C(NN)c1csc(C)c1
InChIInChI=1S/C12H22N2OS/c1-4-6-11(15-5-2)12(14-13)10-7-9(3)16-8-10/h7-8,11-12,14H,4-6,13H2,1-3H3
InChIKeySEYSBJDIZZZJFP-UHFFFAOYSA-N
XLogP2.77
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.39
LogP ≤ 52.77
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 [2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine?
The IUPAC name of [2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine (CID 105271529) is [2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine.
What is the SMILES notation for [2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine?
The canonical SMILES for [2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine is CCCC(OCC)C(NN)c1csc(C)c1.
What is the InChIKey of [2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine?
The InChIKey is SEYSBJDIZZZJFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2OS/c1-4-6-11(15-5-2)12(14-13)10-7-9(3)16-8-10/h7-8,11-12,14H,4-6,13H2,1-3H3.
What are the key properties of [2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine?
[2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine has a molecular weight of 242.39 g/mol, XLogP of 2.77, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethoxy-1-(5-methylthiophen-3-yl)pentyl]hydrazine is sourced from PubChem (CID 105271529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).