[1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine

C10H20N2OS — CID 102649993

IUPAC[1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine
SMILESCCCSCC(NN)C1=CCCCO1
InChIInChI=1S/C10H20N2OS/c1-2-7-14-8-9(12-11)10-5-3-4-6-13-10/h5,9,12H,2-4,6-8,11H2,1H3
InChIKeyAGLKATYBJMURPD-UHFFFAOYSA-N
MW216.35 g/mol
LogP1.66
Rot. Bonds6

About [1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine

[1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine (PubChem CID 102649993) has the molecular formula C10H20N2OS and a molecular weight of 216.35 g/mol. Its IUPAC name is [1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine
PubChem CID102649993
Molecular FormulaC10H20N2OS
Molecular Weight216.35 g/mol
Exact Mass216.13
IUPAC Name[1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine
SMILESCCCSCC(NN)C1=CCCCO1
InChIInChI=1S/C10H20N2OS/c1-2-7-14-8-9(12-11)10-5-3-4-6-13-10/h5,9,12H,2-4,6-8,11H2,1H3
InChIKeyAGLKATYBJMURPD-UHFFFAOYSA-N
XLogP1.66
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 51.66
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-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine?
The IUPAC name of [1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine (CID 102649993) is [1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine.
What is the SMILES notation for [1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine?
The canonical SMILES for [1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine is CCCSCC(NN)C1=CCCCO1.
What is the InChIKey of [1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine?
The InChIKey is AGLKATYBJMURPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2OS/c1-2-7-14-8-9(12-11)10-5-3-4-6-13-10/h5,9,12H,2-4,6-8,11H2,1H3.
What are the key properties of [1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine?
[1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine has a molecular weight of 216.35 g/mol, XLogP of 1.66, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine is sourced from PubChem (CID 102649993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).