1-(2-hydroxyethyl)imidazolidine-2-thione

C5H10N2OS — CID 2801741

IUPAC1-(2-hydroxyethyl)imidazolidine-2-thione
SMILESOCCN1CCNC1=S
InChIInChI=1S/C5H10N2OS/c8-4-3-7-2-1-6-5(7)9/h8H,1-4H2,(H,6,9)
InChIKeyAFEITPOSEVENMK-UHFFFAOYSA-N
MW146.22 g/mol
LogP-0.83
Rot. Bonds2

About 1-(2-hydroxyethyl)imidazolidine-2-thione

1-(2-hydroxyethyl)imidazolidine-2-thione (PubChem CID 2801741) has the molecular formula C5H10N2OS and a molecular weight of 146.22 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)imidazolidine-2-thione.

Molecular Properties

Compound Name1-(2-hydroxyethyl)imidazolidine-2-thione
PubChem CID2801741
Molecular FormulaC5H10N2OS
Molecular Weight146.22 g/mol
Exact Mass146.05
IUPAC Name1-(2-hydroxyethyl)imidazolidine-2-thione
SMILESOCCN1CCNC1=S
InChIInChI=1S/C5H10N2OS/c8-4-3-7-2-1-6-5(7)9/h8H,1-4H2,(H,6,9)
InChIKeyAFEITPOSEVENMK-UHFFFAOYSA-N
XLogP-0.83
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.22
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)imidazolidine-2-thione?
The IUPAC name of 1-(2-hydroxyethyl)imidazolidine-2-thione (CID 2801741) is 1-(2-hydroxyethyl)imidazolidine-2-thione.
What is the SMILES notation for 1-(2-hydroxyethyl)imidazolidine-2-thione?
The canonical SMILES for 1-(2-hydroxyethyl)imidazolidine-2-thione is OCCN1CCNC1=S.
What is the InChIKey of 1-(2-hydroxyethyl)imidazolidine-2-thione?
The InChIKey is AFEITPOSEVENMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2OS/c8-4-3-7-2-1-6-5(7)9/h8H,1-4H2,(H,6,9).
What are the key properties of 1-(2-hydroxyethyl)imidazolidine-2-thione?
1-(2-hydroxyethyl)imidazolidine-2-thione has a molecular weight of 146.22 g/mol, XLogP of -0.83, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)imidazolidine-2-thione is sourced from PubChem (CID 2801741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).