[2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine

C10H18N2OS — CID 105227274

IUPAC[2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine
SMILESCCC(C)SCC(NN)c1ccoc1
InChIInChI=1S/C10H18N2OS/c1-3-8(2)14-7-10(12-11)9-4-5-13-6-9/h4-6,8,10,12H,3,7,11H2,1-2H3
InChIKeyNIVRNWSWMOPNQC-UHFFFAOYSA-N
MW214.33 g/mol
LogP2.32
Rot. Bonds6

About [2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine

[2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine (PubChem CID 105227274) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is [2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine
PubChem CID105227274
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC Name[2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine
SMILESCCC(C)SCC(NN)c1ccoc1
InChIInChI=1S/C10H18N2OS/c1-3-8(2)14-7-10(12-11)9-4-5-13-6-9/h4-6,8,10,12H,3,7,11H2,1-2H3
InChIKeyNIVRNWSWMOPNQC-UHFFFAOYSA-N
XLogP2.32
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 52.32
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-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine?
The IUPAC name of [2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine (CID 105227274) is [2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine is CCC(C)SCC(NN)c1ccoc1.
What is the InChIKey of [2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine?
The InChIKey is NIVRNWSWMOPNQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2OS/c1-3-8(2)14-7-10(12-11)9-4-5-13-6-9/h4-6,8,10,12H,3,7,11H2,1-2H3.
What are the key properties of [2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine?
[2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine has a molecular weight of 214.33 g/mol, XLogP of 2.32, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-butan-2-ylsulfanyl-1-(furan-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105227274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).