(1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine

C11H24N2OS — CID 105227374

IUPAC(1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine
SMILESCCCOCC(CSC1CCCC1)NN
InChIInChI=1S/C11H24N2OS/c1-2-7-14-8-10(13-12)9-15-11-5-3-4-6-11/h10-11,13H,2-9,12H2,1H3
InChIKeyZMWLDUMEHUOXOV-UHFFFAOYSA-N
MW232.39 g/mol
LogP1.92
Rot. Bonds8

About (1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine

(1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine (PubChem CID 105227374) has the molecular formula C11H24N2OS and a molecular weight of 232.39 g/mol. Its IUPAC name is (1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine.

Molecular Properties

Compound Name(1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine
PubChem CID105227374
Molecular FormulaC11H24N2OS
Molecular Weight232.39 g/mol
Exact Mass232.16
IUPAC Name(1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine
SMILESCCCOCC(CSC1CCCC1)NN
InChIInChI=1S/C11H24N2OS/c1-2-7-14-8-10(13-12)9-15-11-5-3-4-6-11/h10-11,13H,2-9,12H2,1H3
InChIKeyZMWLDUMEHUOXOV-UHFFFAOYSA-N
XLogP1.92
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.39
LogP ≤ 51.92
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-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine?
The IUPAC name of (1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine (CID 105227374) is (1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine.
What is the SMILES notation for (1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine?
The canonical SMILES for (1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine is CCCOCC(CSC1CCCC1)NN.
What is the InChIKey of (1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine?
The InChIKey is ZMWLDUMEHUOXOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2OS/c1-2-7-14-8-10(13-12)9-15-11-5-3-4-6-11/h10-11,13H,2-9,12H2,1H3.
What are the key properties of (1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine?
(1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine has a molecular weight of 232.39 g/mol, XLogP of 1.92, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclopentylsulfanyl-3-propoxypropan-2-yl)hydrazine is sourced from PubChem (CID 105227374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).