[2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine

C12H24N2OS — CID 107139567

IUPAC[2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine
SMILESNNC(CSC1CCCC1)C1CCCOC1
InChIInChI=1S/C12H24N2OS/c13-14-12(10-4-3-7-15-8-10)9-16-11-5-1-2-6-11/h10-12,14H,1-9,13H2
InChIKeyFSTWHFUFRBXIPR-UHFFFAOYSA-N
MW244.40 g/mol
LogP1.92
Rot. Bonds5

About [2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine

[2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine (PubChem CID 107139567) has the molecular formula C12H24N2OS and a molecular weight of 244.40 g/mol. Its IUPAC name is [2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine
PubChem CID107139567
Molecular FormulaC12H24N2OS
Molecular Weight244.40 g/mol
Exact Mass244.16
IUPAC Name[2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine
SMILESNNC(CSC1CCCC1)C1CCCOC1
InChIInChI=1S/C12H24N2OS/c13-14-12(10-4-3-7-15-8-10)9-16-11-5-1-2-6-11/h10-12,14H,1-9,13H2
InChIKeyFSTWHFUFRBXIPR-UHFFFAOYSA-N
XLogP1.92
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.40
LogP ≤ 51.92
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-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine?
The IUPAC name of [2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine (CID 107139567) is [2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine is NNC(CSC1CCCC1)C1CCCOC1.
What is the InChIKey of [2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine?
The InChIKey is FSTWHFUFRBXIPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2OS/c13-14-12(10-4-3-7-15-8-10)9-16-11-5-1-2-6-11/h10-12,14H,1-9,13H2.
What are the key properties of [2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine?
[2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine has a molecular weight of 244.40 g/mol, XLogP of 1.92, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclopentylsulfanyl-1-(oxan-3-yl)ethyl]hydrazine is sourced from PubChem (CID 107139567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).