[1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine

C11H20N2OS — CID 102843370

IUPAC[1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine
SMILESCCCOCCC(NN)c1ccsc1C
InChIInChI=1S/C11H20N2OS/c1-3-6-14-7-4-11(13-12)10-5-8-15-9(10)2/h5,8,11,13H,3-4,6-7,12H2,1-2H3
InChIKeyRDYXMHSWFUMIGG-UHFFFAOYSA-N
MW228.36 g/mol
LogP2.38
Rot. Bonds7

About [1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine

[1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine (PubChem CID 102843370) has the molecular formula C11H20N2OS and a molecular weight of 228.36 g/mol. Its IUPAC name is [1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine.

Molecular Properties

Compound Name[1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine
PubChem CID102843370
Molecular FormulaC11H20N2OS
Molecular Weight228.36 g/mol
Exact Mass228.13
IUPAC Name[1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine
SMILESCCCOCCC(NN)c1ccsc1C
InChIInChI=1S/C11H20N2OS/c1-3-6-14-7-4-11(13-12)10-5-8-15-9(10)2/h5,8,11,13H,3-4,6-7,12H2,1-2H3
InChIKeyRDYXMHSWFUMIGG-UHFFFAOYSA-N
XLogP2.38
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine?
The IUPAC name of [1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine (CID 102843370) is [1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine.
What is the SMILES notation for [1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine?
The canonical SMILES for [1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine is CCCOCCC(NN)c1ccsc1C.
What is the InChIKey of [1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine?
The InChIKey is RDYXMHSWFUMIGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2OS/c1-3-6-14-7-4-11(13-12)10-5-8-15-9(10)2/h5,8,11,13H,3-4,6-7,12H2,1-2H3.
What are the key properties of [1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine?
[1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine has a molecular weight of 228.36 g/mol, XLogP of 2.38, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methylthiophen-3-yl)-3-propoxypropyl]hydrazine is sourced from PubChem (CID 102843370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).