[2-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine

C11H18N2S — CID 105310138

IUPAC[2-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine
SMILESCc1ccsc1C(CC1CCC1)NN
InChIInChI=1S/C11H18N2S/c1-8-5-6-14-11(8)10(13-12)7-9-3-2-4-9/h5-6,9-10,13H,2-4,7,12H2,1H3
InChIKeyKZGBUNBHLHLGLO-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.75
Rot. Bonds4

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

[2-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine (PubChem CID 105310138) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is [2-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine
PubChem CID105310138
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name[2-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine
SMILESCc1ccsc1C(CC1CCC1)NN
InChIInChI=1S/C11H18N2S/c1-8-5-6-14-11(8)10(13-12)7-9-3-2-4-9/h5-6,9-10,13H,2-4,7,12H2,1H3
InChIKeyKZGBUNBHLHLGLO-UHFFFAOYSA-N
XLogP2.75
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine?
The IUPAC name of [2-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine (CID 105310138) is [2-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine is Cc1ccsc1C(CC1CCC1)NN.
What is the InChIKey of [2-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine?
The InChIKey is KZGBUNBHLHLGLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-8-5-6-14-11(8)10(13-12)7-9-3-2-4-9/h5-6,9-10,13H,2-4,7,12H2,1H3.
What are the key properties of [2-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine?
[2-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine has a molecular weight of 210.35 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclobutyl-1-(3-methylthiophen-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105310138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).