[2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine

C10H18N2OS — CID 102843058

IUPAC[2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine
SMILESCCC(OC)C(NN)c1ccsc1C
InChIInChI=1S/C10H18N2OS/c1-4-9(13-3)10(12-11)8-5-6-14-7(8)2/h5-6,9-10,12H,4,11H2,1-3H3
InChIKeyIYLCJDQUTNEZJL-UHFFFAOYSA-N
MW214.33 g/mol
LogP1.99
Rot. Bonds5

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

[2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine (PubChem CID 102843058) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is [2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine.

Molecular Properties

Compound Name[2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine
PubChem CID102843058
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC Name[2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine
SMILESCCC(OC)C(NN)c1ccsc1C
InChIInChI=1S/C10H18N2OS/c1-4-9(13-3)10(12-11)8-5-6-14-7(8)2/h5-6,9-10,12H,4,11H2,1-3H3
InChIKeyIYLCJDQUTNEZJL-UHFFFAOYSA-N
XLogP1.99
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 51.99
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-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine?
The IUPAC name of [2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine (CID 102843058) is [2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine.
What is the SMILES notation for [2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine?
The canonical SMILES for [2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine is CCC(OC)C(NN)c1ccsc1C.
What is the InChIKey of [2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine?
The InChIKey is IYLCJDQUTNEZJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2OS/c1-4-9(13-3)10(12-11)8-5-6-14-7(8)2/h5-6,9-10,12H,4,11H2,1-3H3.
What are the key properties of [2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine?
[2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine has a molecular weight of 214.33 g/mol, XLogP of 1.99, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine is sourced from PubChem (CID 102843058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).